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

Systemtic Name: 1-[(3-cyanophenyl)methyl]-4-methoxy-N-[2-(1-methylpyridin-1-ium-4-yl)ethyl]indole-2-carboxamide Openeye Name: 1-[(3-cyanophenyl)methyl]-4-methoxy-N-[2-(1-methylpyridin-1-ium-4-yl)ethyl]indole-2-carboxamide CAS Name: 1-[(3-cyanophenyl)methyl]-4-methoxy-N-[2-(1-methyl-4-pyridin-1-iumyl)ethyl]-2-indolecarboxamide IUPAC Name: 1-[(3-cyanophenyl)methyl]-4-methoxy-N-[2-(1-methylpyridin-1-ium-4-yl)ethyl]indole-2-carboxamide Traditional Name: 1-(3-cyanobenzyl)-4-methoxy-N-[2-(1-methylpyridin-1-ium-4-yl)ethyl]indole-2-carboxamide Formula: C26H25N4O2+ MolecularWeight: 425.5023

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Descriptors Computed from Structure

Canonical SMILES:

C[N+]1=CC=C(C=C1)CCNC(=O)C2=CC3=C(N2CC4=CC=CC(=C4)C#N)C=CC=C3OC

Isomeric SMILES

C[N+]1=CC=C(C=C1)CCNC(=O)C2=CC3=C(N2CC4=CC=CC(=C4)C#N)C=CC=C3OC

InChI

InChI=1S/C26H24N4O2/c1-29-13-10-19(11-14-29)9-12-28-26(31)24-16-22-23(7-4-8-25(22)32-2)30(24)18-21-6-3-5-20(15-21)17-27/h3-8,10-11,13-16H,9,12,18H2,1-2H3/p+1