(E)-3-[1-(2-cyanoethyl)indol-3-yl]-2-(3-methoxyphenyl)carbonyl-prop-2-enenitrile

Systemtic Name: (E)-3-[1-(2-cyanoethyl)indol-3-yl]-2-(3-methoxyphenyl)carbonyl-prop-2-enenitrile Openeye Name: (E)-3-[1-(2-cyanoethyl)indol-3-yl]-2-(3-methoxybenzoyl)prop-2-enenitrile CAS Name: (E)-3-[1-(2-cyanoethyl)-3-indolyl]-2-[(3-methoxyphenyl)-oxomethyl]-2-propenenitrile IUPAC Name: (E)-3-[1-(2-cyanoethyl)indol-3-yl]-2-(3-methoxybenzoyl)prop-2-enenitrile Traditional Name: (E)-3-[1-(2-cyanoethyl)indol-3-yl]-2-m-anisoyl-acrylonitrile Formula: C22H17N3O2 MolecularWeight: 355.38928

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C22H17N3O2/c1-27-19-7-4-6-16(13-19)22(26)17(14-24)12-18-15-25(11-5-10-23)21-9-3-2-8-20(18)21/h2-4,6-9,12-13,15H,5,11H2,1H3/b17-12+