7-(4-chlorophenyl)-4-(2-ethoxyphenyl)-2-methyl-5-oxidanylidene-4,4a,6,7-tetrahydro-1H-quinoline-3-carbonitrile

Systemtic Name: 7-(4-chlorophenyl)-4-(2-ethoxyphenyl)-2-methyl-5-oxidanylidene-4,4a,6,7-tetrahydro-1H-quinoline-3-carbonitrile Openeye Name: 7-(4-chlorophenyl)-4-(2-ethoxyphenyl)-2-methyl-5-oxo-4,4a,6,7-tetrahydro-1H-quinoline-3-carbonitrile CAS Name: 7-(4-chlorophenyl)-4-(2-ethoxyphenyl)-2-methyl-5-oxo-4,4a,6,7-tetrahydro-1H-quinoline-3-carbonitrile IUPAC Name: 7-(4-chlorophenyl)-4-(2-ethoxyphenyl)-2-methyl-5-oxo-4,4a,6,7-tetrahydro-1H-quinoline-3-carbonitrile Traditional Name: 7-(4-chlorophenyl)-5-keto-2-methyl-4-o-phenetyl-4,4a,6,7-tetrahydro-1H-quinoline-3-carbonitrile Formula: C25H23ClN2O2 MolecularWeight: 418.91532

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=CC=C1C2C3C(=O)CC(C=C3NC(=C2C#N)C)C4=CC=C(C=C4)Cl

Isomeric SMILES

CCOC1=CC=CC=C1C2C3C(=O)CC(C=C3NC(=C2C#N)C)C4=CC=C(C=C4)Cl

InChI

InChI=1S/C25H23ClN2O2/c1-3-30-23-7-5-4-6-19(23)24-20(14-27)15(2)28-21-12-17(13-22(29)25(21)24)16-8-10-18(26)11-9-16/h4-12,17,24-25,28H,3,13H2,1-2H3