(E)-3-(3,4-dimethoxyphenyl)-2-(1-methyl-2-phenyl-indol-3-yl)carbonyl-prop-2-enenitrile

Systemtic Name: (E)-3-(3,4-dimethoxyphenyl)-2-(1-methyl-2-phenyl-indol-3-yl)carbonyl-prop-2-enenitrile Openeye Name: (E)-3-(3,4-dimethoxyphenyl)-2-(1-methyl-2-phenyl-indole-3-carbonyl)prop-2-enenitrile CAS Name: (E)-3-(3,4-dimethoxyphenyl)-2-[(1-methyl-2-phenyl-3-indolyl)-oxomethyl]-2-propenenitrile IUPAC Name: (E)-3-(3,4-dimethoxyphenyl)-2-(1-methyl-2-phenylindole-3-carbonyl)prop-2-enenitrile Traditional Name: (E)-3-(3,4-dimethoxyphenyl)-2-(1-methyl-2-phenyl-indole-3-carbonyl)acrylonitrile Formula: C27H22N2O3 MolecularWeight: 422.47518

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Descriptors Computed from Structure

Canonical SMILES:

CN1C2=CC=CC=C2C(=C1C3=CC=CC=C3)C(=O)C(=CC4=CC(=C(C=C4)OC)OC)C#N

Isomeric SMILES

CN1C2=CC=CC=C2C(=C1C3=CC=CC=C3)C(=O)/C(=C/C4=CC(=C(C=C4)OC)OC)/C#N

InChI

InChI=1S/C27H22N2O3/c1-29-22-12-8-7-11-21(22)25(26(29)19-9-5-4-6-10-19)27(30)20(17-28)15-18-13-14-23(31-2)24(16-18)32-3/h4-16H,1-3H3/b20-15+