4-[1-(2,4-dimethylphenyl)-2-methyl-3-(phenylcarbonyl)indol-5-yl]oxy-3-oxidanylidene-butanenitrile

Systemtic Name: 4-[1-(2,4-dimethylphenyl)-2-methyl-3-(phenylcarbonyl)indol-5-yl]oxy-3-oxidanylidene-butanenitrile Openeye Name: 4-[3-benzoyl-1-(2,4-dimethylphenyl)-2-methyl-indol-5-yl]oxy-3-oxo-butanenitrile CAS Name: 4-[[3-benzoyl-1-(2,4-dimethylphenyl)-2-methyl-5-indolyl]oxy]-3-oxobutanenitrile IUPAC Name: 4-[3-benzoyl-1-(2,4-dimethylphenyl)-2-methylindol-5-yl]oxy-3-oxobutanenitrile Traditional Name: 4-[3-benzoyl-1-(2,4-dimethylphenyl)-2-methyl-indol-5-yl]oxy-3-keto-butyronitrile Formula: C28H24N2O3 MolecularWeight: 436.50176

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)N2C(=C(C3=C2C=CC(=C3)OCC(=O)CC#N)C(=O)C4=CC=CC=C4)C)C

Isomeric SMILES

CC1=CC(=C(C=C1)N2C(=C(C3=C2C=CC(=C3)OCC(=O)CC#N)C(=O)C4=CC=CC=C4)C)C

InChI

InChI=1S/C28H24N2O3/c1-18-9-11-25(19(2)15-18)30-20(3)27(28(32)21-7-5-4-6-8-21)24-16-23(10-12-26(24)30)33-17-22(31)13-14-29/h4-12,15-16H,13,17H2,1-3H3