4-(4-chloranyl-3,5-dimethyl-phenoxy)-2-(1-methylindol-2-yl)-3-oxidanylidene-butanenitrile

Systemtic Name: 4-(4-chloranyl-3,5-dimethyl-phenoxy)-2-(1-methylindol-2-yl)-3-oxidanylidene-butanenitrile Openeye Name: 4-(4-chloro-3,5-dimethyl-phenoxy)-2-(1-methylindol-2-yl)-3-oxo-butanenitrile CAS Name: 4-(4-chloro-3,5-dimethylphenoxy)-2-(1-methyl-2-indolyl)-3-oxobutanenitrile IUPAC Name: 4-(4-chloro-3,5-dimethylphenoxy)-2-(1-methylindol-2-yl)-3-oxobutanenitrile Traditional Name: 4-(4-chloro-3,5-dimethyl-phenoxy)-3-keto-2-(1-methylindol-2-yl)butyronitrile Formula: C21H19ClN2O2 MolecularWeight: 366.84076

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1Cl)C)OCC(=O)C(C#N)C2=CC3=CC=CC=C3N2C

Isomeric SMILES

CC1=CC(=CC(=C1Cl)C)OCC(=O)C(C#N)C2=CC3=CC=CC=C3N2C

InChI

InChI=1S/C21H19ClN2O2/c1-13-8-16(9-14(2)21(13)22)26-12-20(25)17(11-23)19-10-15-6-4-5-7-18(15)24(19)3/h4-10,17H,12H2,1-3H3