(E)-3-(3,5-dimethoxyphenyl)-2-[(4-methyl-1H-indol-3-yl)carbonyl]prop-2-enenitrile

Systemtic Name: (E)-3-(3,5-dimethoxyphenyl)-2-[(4-methyl-1H-indol-3-yl)carbonyl]prop-2-enenitrile Openeye Name: (E)-3-(3,5-dimethoxyphenyl)-2-(4-methyl-1H-indole-3-carbonyl)prop-2-enenitrile CAS Name: (E)-3-(3,5-dimethoxyphenyl)-2-[(4-methyl-1H-indol-3-yl)-oxomethyl]-2-propenenitrile IUPAC Name: (E)-3-(3,5-dimethoxyphenyl)-2-(4-methyl-1H-indole-3-carbonyl)prop-2-enenitrile Traditional Name: (E)-3-(3,5-dimethoxyphenyl)-2-(4-methyl-1H-indole-3-carbonyl)acrylonitrile Formula: C21H18N2O3 MolecularWeight: 346.37922

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C2C(=CC=C1)NC=C2C(=O)C(=CC3=CC(=CC(=C3)OC)OC)C#N

Isomeric SMILES

CC1=C2C(=CC=C1)NC=C2C(=O)/C(=C/C3=CC(=CC(=C3)OC)OC)/C#N

InChI

InChI=1S/C21H18N2O3/c1-13-5-4-6-19-20(13)18(12-23-19)21(24)15(11-22)7-14-8-16(25-2)10-17(9-14)26-3/h4-10,12,23H,1-3H3/b15-7+