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

Systemtic Name: [(2S)-butan-2-yl] (4S,7S)-2-methyl-5-oxidanylidene-7-phenyl-4-pyridin-4-yl-4,6,7,8-tetrahydro-3H-quinoline-3-carboxylate Openeye Name: [(1S)-1-methylpropyl] (4S,7S)-2-methyl-5-oxo-7-phenyl-4-(4-pyridyl)-4,6,7,8-tetrahydro-3H-quinoline-3-carboxylate CAS Name: (4S,7S)-2-methyl-5-oxo-7-phenyl-4-pyridin-4-yl-4,6,7,8-tetrahydro-3H-quinoline-3-carboxylic acid [(2S)-butan-2-yl] ester IUPAC Name: [(2S)-butan-2-yl] (4S,7S)-2-methyl-5-oxo-7-phenyl-4-pyridin-4-yl-4,6,7,8-tetrahydro-3H-quinoline-3-carboxylate Traditional Name: (4S,7S)-5-keto-2-methyl-7-phenyl-4-(4-pyridyl)-4,6,7,8-tetrahydro-3H-quinoline-3-carboxylic acid [(1S)-1-methylpropyl] ester Formula: C26H28N2O3 MolecularWeight: 416.51212

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)OC(=O)C1C(C2=C(CC(CC2=O)C3=CC=CC=C3)N=C1C)C4=CC=NC=C4

Isomeric SMILES

CC[C@H](C)OC(=O)C1[C@H](C2=C(C[C@@H](CC2=O)C3=CC=CC=C3)N=C1C)C4=CC=NC=C4

InChI

InChI=1S/C26H28N2O3/c1-4-16(2)31-26(30)23-17(3)28-21-14-20(18-8-6-5-7-9-18)15-22(29)25(21)24(23)19-10-12-27-13-11-19/h5-13,16,20,23-24H,4,14-15H2,1-3H3/t16-,20-,23?,24+/m0/s1