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

Systemtic Name: 4-(2,4-dimethylphenoxy)-2-(1-methylindol-2-yl)-3-oxidanylidene-butanenitrile Openeye Name: 4-(2,4-dimethylphenoxy)-2-(1-methylindol-2-yl)-3-oxo-butanenitrile CAS Name: 4-(2,4-dimethylphenoxy)-2-(1-methyl-2-indolyl)-3-oxobutanenitrile IUPAC Name: 4-(2,4-dimethylphenoxy)-2-(1-methylindol-2-yl)-3-oxobutanenitrile Traditional Name: 4-(2,4-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=CC(=C(C=C1)OCC(=O)C(C#N)C2=CC3=CC=CC=C3N2C)C

Isomeric SMILES

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

InChI

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