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

Systemtic Name: 4-[2-methyl-3-(phenylcarbonyl)-1-(phenylmethyl)indol-5-yl]oxy-3-oxidanylidene-butanenitrile Openeye Name: 4-(3-benzoyl-1-benzyl-2-methyl-indol-5-yl)oxy-3-oxo-butanenitrile CAS Name: 4-[[3-benzoyl-2-methyl-1-(phenylmethyl)-5-indolyl]oxy]-3-oxobutanenitrile IUPAC Name: 4-(3-benzoyl-1-benzyl-2-methylindol-5-yl)oxy-3-oxobutanenitrile Traditional Name: 4-(3-benzoyl-1-benzyl-2-methyl-indol-5-yl)oxy-3-keto-butyronitrile Formula: C27H22N2O3 MolecularWeight: 422.47518

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C2=C(N1CC3=CC=CC=C3)C=CC(=C2)OCC(=O)CC#N)C(=O)C4=CC=CC=C4

Isomeric SMILES

CC1=C(C2=C(N1CC3=CC=CC=C3)C=CC(=C2)OCC(=O)CC#N)C(=O)C4=CC=CC=C4

InChI

InChI=1S/C27H22N2O3/c1-19-26(27(31)21-10-6-3-7-11-21)24-16-23(32-18-22(30)14-15-28)12-13-25(24)29(19)17-20-8-4-2-5-9-20/h2-13,16H,14,17-18H2,1H3