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

Systemtic Name: cyclohexyl (4R,7S)-2-methyl-5-oxidanylidene-7-phenyl-4-pyridin-4-yl-4,6,7,8-tetrahydro-3H-quinoline-3-carboxylate Openeye Name: cyclohexyl (4R,7S)-2-methyl-5-oxo-7-phenyl-4-(4-pyridyl)-4,6,7,8-tetrahydro-3H-quinoline-3-carboxylate CAS Name: (4R,7S)-2-methyl-5-oxo-7-phenyl-4-pyridin-4-yl-4,6,7,8-tetrahydro-3H-quinoline-3-carboxylic acid cyclohexyl ester IUPAC Name: cyclohexyl (4R,7S)-2-methyl-5-oxo-7-phenyl-4-pyridin-4-yl-4,6,7,8-tetrahydro-3H-quinoline-3-carboxylate Traditional Name: (4R,7S)-5-keto-2-methyl-7-phenyl-4-(4-pyridyl)-4,6,7,8-tetrahydro-3H-quinoline-3-carboxylic acid cyclohexyl ester Formula: C28H30N2O3 MolecularWeight: 442.5494

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC2=C(C(C1C(=O)OC3CCCCC3)C4=CC=NC=C4)C(=O)CC(C2)C5=CC=CC=C5

Isomeric SMILES

CC1=NC2=C([C@H](C1C(=O)OC3CCCCC3)C4=CC=NC=C4)C(=O)C[C@H](C2)C5=CC=CC=C5

InChI

InChI=1S/C28H30N2O3/c1-18-25(28(32)33-22-10-6-3-7-11-22)26(20-12-14-29-15-13-20)27-23(30-18)16-21(17-24(27)31)19-8-4-2-5-9-19/h2,4-5,8-9,12-15,21-22,25-26H,3,6-7,10-11,16-17H2,1H3/t21-,25?,26-/m0/s1