(phenylmethyl) 2-methyl-4-(4-methylphenyl)-5-oxidanylidene-4,4a,6,7-tetrahydro-1H-quinoline-3-carboxylate

Systemtic Name: (phenylmethyl) 2-methyl-4-(4-methylphenyl)-5-oxidanylidene-4,4a,6,7-tetrahydro-1H-quinoline-3-carboxylate Openeye Name: benzyl 2-methyl-5-oxo-4-(p-tolyl)-4,4a,6,7-tetrahydro-1H-quinoline-3-carboxylate CAS Name: 2-methyl-4-(4-methylphenyl)-5-oxo-4,4a,6,7-tetrahydro-1H-quinoline-3-carboxylic acid (phenylmethyl) ester IUPAC Name: benzyl 2-methyl-4-(4-methylphenyl)-5-oxo-4,4a,6,7-tetrahydro-1H-quinoline-3-carboxylate Traditional Name: 5-keto-2-methyl-4-(p-tolyl)-4,4a,6,7-tetrahydro-1H-quinoline-3-carboxylic acid benzyl ester Formula: C25H25NO3 MolecularWeight: 387.4709

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C2C3C(=O)CCC=C3NC(=C2C(=O)OCC4=CC=CC=C4)C

Isomeric SMILES

CC1=CC=C(C=C1)C2C3C(=O)CCC=C3NC(=C2C(=O)OCC4=CC=CC=C4)C

InChI

InChI=1S/C25H25NO3/c1-16-11-13-19(14-12-16)23-22(25(28)29-15-18-7-4-3-5-8-18)17(2)26-20-9-6-10-21(27)24(20)23/h3-5,7-9,11-14,23-24,26H,6,10,15H2,1-2H3