1-(3,4-dihydro-2H-quinolin-1-yl)-N-(dimethylaminomethyl)-1-(1H-indol-3-ylmethyl)-N-(2-oxidanylideneethyl)piperidin-1-ium-4-carboxamide

Systemtic Name: 1-(3,4-dihydro-2H-quinolin-1-yl)-N-(dimethylaminomethyl)-1-(1H-indol-3-ylmethyl)-N-(2-oxidanylideneethyl)piperidin-1-ium-4-carboxamide Openeye Name: 1-(3,4-dihydro-2H-quinolin-1-yl)-N-(dimethylaminomethyl)-1-(1H-indol-3-ylmethyl)-N-(2-oxoethyl)piperidin-1-ium-4-carboxamide CAS Name: 1-(3,4-dihydro-2H-quinolin-1-yl)-N-(dimethylaminomethyl)-1-(1H-indol-3-ylmethyl)-N-(2-oxoethyl)-4-piperidin-1-iumcarboxamide IUPAC Name: 1-(3,4-dihydro-2H-quinolin-1-yl)-N-(dimethylaminomethyl)-1-(1H-indol-3-ylmethyl)-N-(2-oxoethyl)piperidin-1-ium-4-carboxamide Traditional Name: 1-(3,4-dihydro-2H-quinolin-1-yl)-N-(dimethylaminomethyl)-1-(1H-indol-3-ylmethyl)-N-(2-ketoethyl)piperidin-1-ium-4-carboxamide Formula: C29H38N5O2+ MolecularWeight: 488.64432

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)CN(CC=O)C(=O)C1CC[N+](CC1)(CC2=CNC3=CC=CC=C32)N4CCCC5=CC=CC=C54

Isomeric SMILES

CN(C)CN(CC=O)C(=O)C1CC[N+](CC1)(CC2=CNC3=CC=CC=C32)N4CCCC5=CC=CC=C54

InChI

InChI=1S/C29H38N5O2/c1-31(2)22-32(16-19-35)29(36)24-13-17-34(18-14-24,21-25-20-30-27-11-5-4-10-26(25)27)33-15-7-9-23-8-3-6-12-28(23)33/h3-6,8,10-12,19-20,24,30H,7,9,13-18,21-22H2,1-2H3/q+1