(phenylmethyl) (4S)-2-methyl-4-(4-methylphenyl)-5-oxidanylidene-4a,6,7,8-tetrahydro-4H-quinoline-3-carboxylate

Systemtic Name: (phenylmethyl) (4S)-2-methyl-4-(4-methylphenyl)-5-oxidanylidene-4a,6,7,8-tetrahydro-4H-quinoline-3-carboxylate Openeye Name: benzyl (4S)-2-methyl-5-oxo-4-(p-tolyl)-4a,6,7,8-tetrahydro-4H-quinoline-3-carboxylate CAS Name: (4S)-2-methyl-4-(4-methylphenyl)-5-oxo-4a,6,7,8-tetrahydro-4H-quinoline-3-carboxylic acid (phenylmethyl) ester IUPAC Name: benzyl (4S)-2-methyl-4-(4-methylphenyl)-5-oxo-4a,6,7,8-tetrahydro-4H-quinoline-3-carboxylate Traditional Name: (4S)-5-keto-2-methyl-4-(p-tolyl)-4a,6,7,8-tetrahydro-4H-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(=NC(=C2C(=O)OCC4=CC=CC=C4)C)CCCC3=O

Isomeric SMILES

CC1=CC=C(C=C1)[C@@H]2C3C(=NC(=C2C(=O)OCC4=CC=CC=C4)C)CCCC3=O

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/h3-5,7-8,11-14,23-24H,6,9-10,15H2,1-2H3/t23-,24?/m0/s1