1-[[3-(1-azanylethenyl)phenyl]methyl]-4-methoxy-N-[(1-methylpyridin-1-ium-4-yl)-phenyl-methyl]indole-2-carboxamide

Systemtic Name: 1-[[3-(1-azanylethenyl)phenyl]methyl]-4-methoxy-N-[(1-methylpyridin-1-ium-4-yl)-phenyl-methyl]indole-2-carboxamide Openeye Name: 1-[[3-(1-aminovinyl)phenyl]methyl]-4-methoxy-N-[(1-methylpyridin-1-ium-4-yl)-phenyl-methyl]indole-2-carboxamide CAS Name: 1-[[3-(1-aminoethenyl)phenyl]methyl]-4-methoxy-N-[(1-methyl-4-pyridin-1-iumyl)-phenylmethyl]-2-indolecarboxamide IUPAC Name: 1-[[3-(1-aminoethenyl)phenyl]methyl]-4-methoxy-N-[(1-methylpyridin-1-ium-4-yl)-phenylmethyl]indole-2-carboxamide Traditional Name: 1-[3-(1-aminovinyl)benzyl]-4-methoxy-N-[(1-methylpyridin-1-ium-4-yl)-phenyl-methyl]indole-2-carboxamide Formula: C32H31N4O2+ MolecularWeight: 503.61414

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Descriptors Computed from Structure

Canonical SMILES:

C[N+]1=CC=C(C=C1)C(C2=CC=CC=C2)NC(=O)C3=CC4=C(N3CC5=CC=CC(=C5)C(=C)N)C=CC=C4OC

Isomeric SMILES

C[N+]1=CC=C(C=C1)C(C2=CC=CC=C2)NC(=O)C3=CC4=C(N3CC5=CC=CC(=C5)C(=C)N)C=CC=C4OC

InChI

InChI=1S/C32H30N4O2/c1-22(33)26-12-7-9-23(19-26)21-36-28-13-8-14-30(38-3)27(28)20-29(36)32(37)34-31(24-10-5-4-6-11-24)25-15-17-35(2)18-16-25/h4-20,31H,1,21,33H2,2-3H3/p+1