2-(3,4-dimethoxyphenyl)carbonyl-3-(2-methyl-1H-indol-3-yl)-3-oxidanylidene-propanenitrile

Systemtic Name: 2-(3,4-dimethoxyphenyl)carbonyl-3-(2-methyl-1H-indol-3-yl)-3-oxidanylidene-propanenitrile Openeye Name: 2-(3,4-dimethoxybenzoyl)-3-(2-methyl-1H-indol-3-yl)-3-oxo-propanenitrile CAS Name: 2-[(3,4-dimethoxyphenyl)-oxomethyl]-3-(2-methyl-1H-indol-3-yl)-3-oxopropanenitrile IUPAC Name: 2-(3,4-dimethoxybenzoyl)-3-(2-methyl-1H-indol-3-yl)-3-oxopropanenitrile Traditional Name: 3-(3,4-dimethoxyphenyl)-3-keto-2-(2-methyl-1H-indole-3-carbonyl)propionitrile Formula: C21H18N2O4 MolecularWeight: 362.37862

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C2=CC=CC=C2N1)C(=O)C(C#N)C(=O)C3=CC(=C(C=C3)OC)OC

Isomeric SMILES

CC1=C(C2=CC=CC=C2N1)C(=O)C(C#N)C(=O)C3=CC(=C(C=C3)OC)OC

InChI

InChI=1S/C21H18N2O4/c1-12-19(14-6-4-5-7-16(14)23-12)21(25)15(11-22)20(24)13-8-9-17(26-2)18(10-13)27-3/h4-10,15,23H,1-3H3