(phenylmethyl) (4R,7S)-2-methyl-5-oxidanylidene-7-phenyl-4-pyridin-2-yl-4,6,7,8-tetrahydro-1H-quinoline-3-carboxylate

Systemtic Name: (phenylmethyl) (4R,7S)-2-methyl-5-oxidanylidene-7-phenyl-4-pyridin-2-yl-4,6,7,8-tetrahydro-1H-quinoline-3-carboxylate Openeye Name: benzyl (4R,7S)-2-methyl-5-oxo-7-phenyl-4-(2-pyridyl)-4,6,7,8-tetrahydro-1H-quinoline-3-carboxylate CAS Name: (4R,7S)-2-methyl-5-oxo-7-phenyl-4-(2-pyridinyl)-4,6,7,8-tetrahydro-1H-quinoline-3-carboxylic acid (phenylmethyl) ester IUPAC Name: benzyl (4R,7S)-2-methyl-5-oxo-7-phenyl-4-pyridin-2-yl-4,6,7,8-tetrahydro-1H-quinoline-3-carboxylate Traditional Name: (4R,7S)-5-keto-2-methyl-7-phenyl-4-(2-pyridyl)-4,6,7,8-tetrahydro-1H-quinoline-3-carboxylic acid benzyl ester Formula: C29H26N2O3 MolecularWeight: 450.52834

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(C2=C(N1)CC(CC2=O)C3=CC=CC=C3)C4=CC=CC=N4)C(=O)OCC5=CC=CC=C5

Isomeric SMILES

CC1=C([C@@H](C2=C(N1)C[C@@H](CC2=O)C3=CC=CC=C3)C4=CC=CC=N4)C(=O)OCC5=CC=CC=C5

InChI

InChI=1S/C29H26N2O3/c1-19-26(29(33)34-18-20-10-4-2-5-11-20)28(23-14-8-9-15-30-23)27-24(31-19)16-22(17-25(27)32)21-12-6-3-7-13-21/h2-15,22,28,31H,16-18H2,1H3/t22-,28-/m0/s1