4-(3,4-dimethylphenoxy)-2-(1-methylindol-2-yl)-3-oxidanylidene-butanenitrile

Systemtic Name: 4-(3,4-dimethylphenoxy)-2-(1-methylindol-2-yl)-3-oxidanylidene-butanenitrile Openeye Name: 4-(3,4-dimethylphenoxy)-2-(1-methylindol-2-yl)-3-oxo-butanenitrile CAS Name: 4-(3,4-dimethylphenoxy)-2-(1-methyl-2-indolyl)-3-oxobutanenitrile IUPAC Name: 4-(3,4-dimethylphenoxy)-2-(1-methylindol-2-yl)-3-oxobutanenitrile Traditional Name: 4-(3,4-dimethylphenoxy)-3-keto-2-(1-methylindol-2-yl)butyronitrile Formula: C21H20N2O2 MolecularWeight: 332.3957

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)OCC(=O)C(C#N)C2=CC3=CC=CC=C3N2C)C

Isomeric SMILES

CC1=C(C=C(C=C1)OCC(=O)C(C#N)C2=CC3=CC=CC=C3N2C)C

InChI

InChI=1S/C21H20N2O2/c1-14-8-9-17(10-15(14)2)25-13-21(24)18(12-22)20-11-16-6-4-5-7-19(16)23(20)3/h4-11,18H,13H2,1-3H3