(Q27093270)

3,8-DIAMINO-6-PHENYL-5-[6-[1-[2-[(1,2,3,4-TETRAHYDRO-9-ACRIDINYL)AMINO]ETHYL]-1H-1,2,3-TRIAZOL-4-YL]HEXYL]-PHENANTHRIDINIUM (English)

19 October 2016

chemical formula

C₄₂H₄₅N₈⁺

1 reference

based on heuristic

inferred from SMILES

canonical SMILES

C1CCC2=NC3=CC=CC=C3C(=C2C1)NCCN4C=C(N=N4)CCCCCC[N+]5=C6C=C(C=CC6=C7C=CC(=CC7=C5C8=CC=CC=C8)N)N

1 reference

3,8-DIAMINO-6-PHENYL-5-[6-[1-[2-[(1,2,3,4-TETRAHYDRO-9-ACRIDINYL)AMINO]ETHYL]-1H-1,2,3-TRIAZOL-4-YL]HEXYL]-PHENANTHRIDINIUM (English)

InChI=1S/C42H44N8/c43-30-19-21-33-34-22-20-31(44)27-40(34)50(42(37(33)26-30)29-12-4-3-5-13-29)24-11-2-1-6-14-32-28-49(48-47-32)25-23-45-41-35-15-7-9-17-38(35)46-39-18-10-8-16-36(39)41/h3-5,7,9,12-13,15,17,19-22,26-28,44H,1-2,6,8,10-11,14,16,18,23-25,43H2,(H,45,46)/p+1

19 October 2016

Identifiers

InChI

1 reference

3,8-DIAMINO-6-PHENYL-5-[6-[1-[2-[(1,2,3,4-TETRAHYDRO-9-ACRIDINYL)AMINO]ETHYL]-1H-1,2,3-TRIAZOL-4-YL]HEXYL]-PHENANTHRIDINIUM (English)

NAARZDJZGYBXKL-UHFFFAOYSA-O

19 October 2016

InChIKey

1 reference

3,8-DIAMINO-6-PHENYL-5-[6-[1-[2-[(1,2,3,4-TETRAHYDRO-9-ACRIDINYL)AMINO]ETHYL]-1H-1,2,3-TRIAZOL-4-YL]HEXYL]-PHENANTHRIDINIUM (English)

19 October 2016

1 reference

3,8-Diamino-6-phenyl-5-(6-{1-[2-(1,2,3,4-tetrahydro-9-acridinylamino)ethyl]-1H-1,2,3-triazol-4-yl}hexyl)phenanthridinium (English)

19 October 2016

1 reference

3,8-DIAMINO-6-PHENYL-5-[6-[1-[2-[(1,2,3,4-TETRAHYDRO-9-ACRIDINYL)AMINO]ETHYL]-1H-1,2,3-TRIAZOL-4-YL]HEXYL]-PHENANTHRIDINIUM (English)

19 October 2016

1 reference

CHEMBL455333 (English)

19 October 2016

1 reference

1 reference

3,8-Diamino-6-Phenyl-5-[6-[1-[2-[(1,2,3,4-Tetrahydro-9-Acridinyl)Amino]Ethyl]-1h-1,2,3-Triazol-4-Yl]Hexyl]-Phenanthridinium (English)

19 October 2016

0 references

0 references

1 reference

1Q84 (English)

19 October 2016

1 reference

2XUQ (English)

19 October 2016

1 reference

2XUH (English)

19 October 2016

1 reference

2XUO (English)

19 October 2016

1 reference

2XUG (English)

19 October 2016

1 reference

2XUF (English)