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

Systemtic Name: 4-[1-(4-ethoxyphenyl)-2-methyl-3-(phenylcarbonyl)indol-5-yl]oxy-3-oxidanylidene-butanenitrile Openeye Name: 4-[3-benzoyl-1-(4-ethoxyphenyl)-2-methyl-indol-5-yl]oxy-3-oxo-butanenitrile CAS Name: 4-[[3-benzoyl-1-(4-ethoxyphenyl)-2-methyl-5-indolyl]oxy]-3-oxobutanenitrile IUPAC Name: 4-[3-benzoyl-1-(4-ethoxyphenyl)-2-methylindol-5-yl]oxy-3-oxobutanenitrile Traditional Name: 4-(3-benzoyl-2-methyl-1-p-phenetyl-indol-5-yl)oxy-3-keto-butyronitrile Formula: C28H24N2O4 MolecularWeight: 452.50116

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)N2C(=C(C3=C2C=CC(=C3)OCC(=O)CC#N)C(=O)C4=CC=CC=C4)C

Isomeric SMILES

CCOC1=CC=C(C=C1)N2C(=C(C3=C2C=CC(=C3)OCC(=O)CC#N)C(=O)C4=CC=CC=C4)C

InChI

InChI=1S/C28H24N2O4/c1-3-33-23-11-9-21(10-12-23)30-19(2)27(28(32)20-7-5-4-6-8-20)25-17-24(13-14-26(25)30)34-18-22(31)15-16-29/h4-14,17H,3,15,18H2,1-2H3