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

Systemtic Name: cyclohexyl (4S,7R)-2-methyl-5-oxidanylidene-7-phenyl-4-(4-phenylmethoxyphenyl)-4,6,7,8-tetrahydro-3H-quinoline-3-carboxylate Openeye Name: cyclohexyl (4S,7R)-4-(4-benzyloxyphenyl)-2-methyl-5-oxo-7-phenyl-4,6,7,8-tetrahydro-3H-quinoline-3-carboxylate CAS Name: (4S,7R)-2-methyl-5-oxo-7-phenyl-4-(4-phenylmethoxyphenyl)-4,6,7,8-tetrahydro-3H-quinoline-3-carboxylic acid cyclohexyl ester IUPAC Name: cyclohexyl (4S,7R)-2-methyl-5-oxo-7-phenyl-4-(4-phenylmethoxyphenyl)-4,6,7,8-tetrahydro-3H-quinoline-3-carboxylate Traditional Name: (4S,7R)-4-(4-benzoxyphenyl)-5-keto-2-methyl-7-phenyl-4,6,7,8-tetrahydro-3H-quinoline-3-carboxylic acid cyclohexyl ester Formula: C36H37NO4 MolecularWeight: 547.68328

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC2=C(C(C1C(=O)OC3CCCCC3)C4=CC=C(C=C4)OCC5=CC=CC=C5)C(=O)CC(C2)C6=CC=CC=C6

Isomeric SMILES

CC1=NC2=C([C@@H](C1C(=O)OC3CCCCC3)C4=CC=C(C=C4)OCC5=CC=CC=C5)C(=O)C[C@@H](C2)C6=CC=CC=C6

InChI

InChI=1S/C36H37NO4/c1-24-33(36(39)41-30-15-9-4-10-16-30)34(27-17-19-29(20-18-27)40-23-25-11-5-2-6-12-25)35-31(37-24)21-28(22-32(35)38)26-13-7-3-8-14-26/h2-3,5-8,11-14,17-20,28,30,33-34H,4,9-10,15-16,21-23H2,1H3/t28-,33?,34-/m1/s1