(Q27220043)

BRD-K32053286-001-01-9 (English)

11 October 2016

chemical formula

C₂₆H₂₈N₄O

1 reference

BRD-K32053286-001-01-9 (English)

11 October 2016

canonical SMILES

CN(C)C(=O)C1=CC=CC(=C1)C2=CC=C(C=C2)C3C4CNCC3N4CC5=CN=CC=C5

1 reference

BRD-K32053286-001-01-9 (English)

11 October 2016

isomeric SMILES

CN(C)C(=O)C1=CC=CC(=C1)C2=CC=C(C=C2)C3[C@H]4CNC[C@@H]3N4CC5=CN=CC=C5

1 reference

BRD-K32053286-001-01-9 (English)

InChI=1S/C26H28N4O/c1-29(2)26(31)22-7-3-6-21(13-22)19-8-10-20(11-9-19)25-23-15-28-16-24(25)30(23)17-18-5-4-12-27-14-18/h3-14,23-25,28H,15-17H2,1-2H3/t23-,24+,25?

11 October 2016

Identifiers

InChI

1 reference

BRD-K32053286-001-01-9 (English)

RDJJKFXXHAYOIA-XMGLRAKGSA-N

11 October 2016

InChIKey

2 references

BRD-K32053286-001-01-9 (English)

11 October 2016

stated in

ChEBI release 2020-09-01

1 reference

BRD-K32053286-001-01-9 (English)

11 October 2016

ChEBI ID

127472

mapping relation type

1 reference