(E)-2-cyano-3-[1-(2-cyanoethyl)indol-3-yl]-N-(3,4-dimethoxyphenyl)prop-2-enamide

Systemtic Name: (E)-2-cyano-3-[1-(2-cyanoethyl)indol-3-yl]-N-(3,4-dimethoxyphenyl)prop-2-enamide Openeye Name: (E)-2-cyano-3-[1-(2-cyanoethyl)indol-3-yl]-N-(3,4-dimethoxyphenyl)prop-2-enamide CAS Name: (E)-2-cyano-3-[1-(2-cyanoethyl)-3-indolyl]-N-(3,4-dimethoxyphenyl)-2-propenamide IUPAC Name: (E)-2-cyano-3-[1-(2-cyanoethyl)indol-3-yl]-N-(3,4-dimethoxyphenyl)prop-2-enamide Traditional Name: (E)-2-cyano-3-[1-(2-cyanoethyl)indol-3-yl]-N-(3,4-dimethoxyphenyl)acrylamide Formula: C23H20N4O3 MolecularWeight: 400.4299

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)NC(=O)C(=CC2=CN(C3=CC=CC=C32)CCC#N)C#N)OC

Isomeric SMILES

COC1=C(C=C(C=C1)NC(=O)/C(=C/C2=CN(C3=CC=CC=C32)CCC#N)/C#N)OC

InChI

InChI=1S/C23H20N4O3/c1-29-21-9-8-18(13-22(21)30-2)26-23(28)16(14-25)12-17-15-27(11-5-10-24)20-7-4-3-6-19(17)20/h3-4,6-9,12-13,15H,5,11H2,1-2H3,(H,26,28)/b16-12+