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

Systemtic Name: (phenylmethyl) (4S)-2-methyl-5-oxidanylidene-4-pyridin-2-yl-4,6,7,8-tetrahydro-3H-quinoline-3-carboxylate Openeye Name: benzyl (4S)-2-methyl-5-oxo-4-(2-pyridyl)-4,6,7,8-tetrahydro-3H-quinoline-3-carboxylate CAS Name: (4S)-2-methyl-5-oxo-4-(2-pyridinyl)-4,6,7,8-tetrahydro-3H-quinoline-3-carboxylic acid (phenylmethyl) ester IUPAC Name: benzyl (4S)-2-methyl-5-oxo-4-pyridin-2-yl-4,6,7,8-tetrahydro-3H-quinoline-3-carboxylate Traditional Name: (4S)-5-keto-2-methyl-4-(2-pyridyl)-4,6,7,8-tetrahydro-3H-quinoline-3-carboxylic acid benzyl ester Formula: C23H22N2O3 MolecularWeight: 374.43238

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC2=C(C(C1C(=O)OCC3=CC=CC=C3)C4=CC=CC=N4)C(=O)CCC2

Isomeric SMILES

CC1=NC2=C([C@H](C1C(=O)OCC3=CC=CC=C3)C4=CC=CC=N4)C(=O)CCC2

InChI

InChI=1S/C23H22N2O3/c1-15-20(23(27)28-14-16-8-3-2-4-9-16)22(17-10-5-6-13-24-17)21-18(25-15)11-7-12-19(21)26/h2-6,8-10,13,20,22H,7,11-12,14H2,1H3/t20?,22-/m0/s1