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

Systemtic Name: cyclohexyl (4S,7R)-4-(4-dimethylaminophenyl)-2-methyl-5-oxidanylidene-7-phenyl-4,6,7,8-tetrahydro-3H-quinoline-3-carboxylate Openeye Name: cyclohexyl (4S,7R)-4-(4-dimethylaminophenyl)-2-methyl-5-oxo-7-phenyl-4,6,7,8-tetrahydro-3H-quinoline-3-carboxylate CAS Name: (4S,7R)-4-(4-dimethylaminophenyl)-2-methyl-5-oxo-7-phenyl-4,6,7,8-tetrahydro-3H-quinoline-3-carboxylic acid cyclohexyl ester IUPAC Name: cyclohexyl (4S,7R)-4-(4-dimethylaminophenyl)-2-methyl-5-oxo-7-phenyl-4,6,7,8-tetrahydro-3H-quinoline-3-carboxylate Traditional Name: (4S,7R)-4-(4-dimethylaminophenyl)-5-keto-2-methyl-7-phenyl-4,6,7,8-tetrahydro-3H-quinoline-3-carboxylic acid cyclohexyl ester Formula: C31H36N2O3 MolecularWeight: 484.62914

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C31H36N2O3/c1-20-28(31(35)36-25-12-8-5-9-13-25)29(22-14-16-24(17-15-22)33(2)3)30-26(32-20)18-23(19-27(30)34)21-10-6-4-7-11-21/h4,6-7,10-11,14-17,23,25,28-29H,5,8-9,12-13,18-19H2,1-3H3/t23-,28?,29-/m1/s1