N-[2-(3,4-dimethoxyphenyl)ethyl]-1-[2-(1H-indol-3-yl)ethyl]-6-oxidanylidene-pyridine-3-carboxamide

Systemtic Name: N-[2-(3,4-dimethoxyphenyl)ethyl]-1-[2-(1H-indol-3-yl)ethyl]-6-oxidanylidene-pyridine-3-carboxamide Openeye Name: N-[2-(3,4-dimethoxyphenyl)ethyl]-1-[2-(1H-indol-3-yl)ethyl]-6-oxo-pyridine-3-carboxamide CAS Name: N-[2-(3,4-dimethoxyphenyl)ethyl]-1-[2-(1H-indol-3-yl)ethyl]-6-oxo-3-pyridinecarboxamide IUPAC Name: N-[2-(3,4-dimethoxyphenyl)ethyl]-1-[2-(1H-indol-3-yl)ethyl]-6-oxopyridine-3-carboxamide Traditional Name: N-homoveratryl-1-[2-(1H-indol-3-yl)ethyl]-6-keto-nicotinamide Formula: C26H27N3O4 MolecularWeight: 445.51028

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)CCNC(=O)C2=CN(C(=O)C=C2)CCC3=CNC4=CC=CC=C43)OC

Isomeric SMILES

COC1=C(C=C(C=C1)CCNC(=O)C2=CN(C(=O)C=C2)CCC3=CNC4=CC=CC=C43)OC

InChI

InChI=1S/C26H27N3O4/c1-32-23-9-7-18(15-24(23)33-2)11-13-27-26(31)20-8-10-25(30)29(17-20)14-12-19-16-28-22-6-4-3-5-21(19)22/h3-10,15-17,28H,11-14H2,1-2H3,(H,27,31)