(E)-2-(1-ethyl-2-phenyl-indol-3-yl)carbonyl-3-(3-methoxyphenyl)prop-2-enenitrile

Systemtic Name: (E)-2-(1-ethyl-2-phenyl-indol-3-yl)carbonyl-3-(3-methoxyphenyl)prop-2-enenitrile Openeye Name: (E)-2-(1-ethyl-2-phenyl-indole-3-carbonyl)-3-(3-methoxyphenyl)prop-2-enenitrile CAS Name: (E)-2-[(1-ethyl-2-phenyl-3-indolyl)-oxomethyl]-3-(3-methoxyphenyl)-2-propenenitrile IUPAC Name: (E)-2-(1-ethyl-2-phenylindole-3-carbonyl)-3-(3-methoxyphenyl)prop-2-enenitrile Traditional Name: (E)-2-(1-ethyl-2-phenyl-indole-3-carbonyl)-3-(3-methoxyphenyl)acrylonitrile Formula: C27H22N2O2 MolecularWeight: 406.47578

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C2=CC=CC=C2C(=C1C3=CC=CC=C3)C(=O)C(=CC4=CC(=CC=C4)OC)C#N

Isomeric SMILES

CCN1C2=CC=CC=C2C(=C1C3=CC=CC=C3)C(=O)/C(=C/C4=CC(=CC=C4)OC)/C#N

InChI

InChI=1S/C27H22N2O2/c1-3-29-24-15-8-7-14-23(24)25(26(29)20-11-5-4-6-12-20)27(30)21(18-28)16-19-10-9-13-22(17-19)31-2/h4-17H,3H2,1-2H3/b21-16+