(Q27120495)

N-METHYL-N-(PARA-GLUTARAMIDOPHENYL-ETHYL)-PIPERIDINIUM ION (English)

19 October 2016

chemical formula

C₁₉H₂₉N₂O₃⁺

1 reference

based on heuristic

inferred from SMILES

canonical SMILES

C[N+]1(CCCCC1)CCC2=CC=C(C=C2)NC(=O)CCCC(=O)O

1 reference

N-METHYL-N-(PARA-GLUTARAMIDOPHENYL-ETHYL)-PIPERIDINIUM ION (English)

InChI=1S/C19H28N2O3/c1-21(13-3-2-4-14-21)15-12-16-8-10-17(11-9-16)20-18(22)6-5-7-19(23)24/h8-11H,2-7,12-15H2,1H3,(H-,20,22,23,24)/p+1

19 October 2016

Identifiers

InChI

1 reference

N-METHYL-N-(PARA-GLUTARAMIDOPHENYL-ETHYL)-PIPERIDINIUM ION (English)

OKJUVEGXNINONS-UHFFFAOYSA-O

19 October 2016

InChIKey

2 references

N-METHYL-N-(PARA-GLUTARAMIDOPHENYL-ETHYL)-PIPERIDINIUM ION (English)

19 October 2016

stated in

ChEBI release 2020-09-01

1 reference

1-(2-{4-[(4-Carboxybutanoyl)amino]phenyl}ethyl)-1-methylpiperidinium (English)

19 October 2016

1 reference

N-METHYL-N-(PARA-GLUTARAMIDOPHENYL-ETHYL)-PIPERIDINIUM ION (English)

19 October 2016

ChEBI ID

42893

mapping relation type

1 reference

1-(2-{4-[(4-carboxybutanoyl)amino]phenyl}ethyl)-1-methylpiperidinium (English)

19 October 2016

1 reference

0 references

1 reference

25C8 (English)