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

Systemtic Name: cyclohexyl (4S)-2-methyl-5-oxidanylidene-4-(2-phenylmethoxyphenyl)-4,6,7,8-tetrahydro-3H-quinoline-3-carboxylate Openeye Name: cyclohexyl (4S)-4-(2-benzyloxyphenyl)-2-methyl-5-oxo-4,6,7,8-tetrahydro-3H-quinoline-3-carboxylate CAS Name: (4S)-2-methyl-5-oxo-4-(2-phenylmethoxyphenyl)-4,6,7,8-tetrahydro-3H-quinoline-3-carboxylic acid cyclohexyl ester IUPAC Name: cyclohexyl (4S)-2-methyl-5-oxo-4-(2-phenylmethoxyphenyl)-4,6,7,8-tetrahydro-3H-quinoline-3-carboxylate Traditional Name: (4S)-4-(2-benzoxyphenyl)-5-keto-2-methyl-4,6,7,8-tetrahydro-3H-quinoline-3-carboxylic acid cyclohexyl ester Formula: C30H33NO4 MolecularWeight: 471.58732

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC2=C(C(C1C(=O)OC3CCCCC3)C4=CC=CC=C4OCC5=CC=CC=C5)C(=O)CCC2

Isomeric SMILES

CC1=NC2=C([C@@H](C1C(=O)OC3CCCCC3)C4=CC=CC=C4OCC5=CC=CC=C5)C(=O)CCC2

InChI

InChI=1S/C30H33NO4/c1-20-27(30(33)35-22-13-6-3-7-14-22)28(29-24(31-20)16-10-17-25(29)32)23-15-8-9-18-26(23)34-19-21-11-4-2-5-12-21/h2,4-5,8-9,11-12,15,18,22,27-28H,3,6-7,10,13-14,16-17,19H2,1H3/t27?,28-/m1/s1