propan-2-yl (4S)-2,7,7-trimethyl-5-oxidanylidene-4-(4-phenylmethoxyphenyl)-3,4,6,8-tetrahydroquinoline-3-carboxylate

Systemtic Name: propan-2-yl (4S)-2,7,7-trimethyl-5-oxidanylidene-4-(4-phenylmethoxyphenyl)-3,4,6,8-tetrahydroquinoline-3-carboxylate Openeye Name: isopropyl (4S)-4-(4-benzyloxyphenyl)-2,7,7-trimethyl-5-oxo-3,4,6,8-tetrahydroquinoline-3-carboxylate CAS Name: (4S)-2,7,7-trimethyl-5-oxo-4-(4-phenylmethoxyphenyl)-3,4,6,8-tetrahydroquinoline-3-carboxylic acid propan-2-yl ester IUPAC Name: propan-2-yl (4S)-2,7,7-trimethyl-5-oxo-4-(4-phenylmethoxyphenyl)-3,4,6,8-tetrahydroquinoline-3-carboxylate Traditional Name: (4S)-4-(4-benzoxyphenyl)-5-keto-2,7,7-trimethyl-3,4,6,8-tetrahydroquinoline-3-carboxylic acid isopropyl ester Formula: C29H33NO4 MolecularWeight: 459.57662

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC2=C(C(C1C(=O)OC(C)C)C3=CC=C(C=C3)OCC4=CC=CC=C4)C(=O)CC(C2)(C)C

Isomeric SMILES

CC1=NC2=C([C@@H](C1C(=O)OC(C)C)C3=CC=C(C=C3)OCC4=CC=CC=C4)C(=O)CC(C2)(C)C

InChI

InChI=1S/C29H33NO4/c1-18(2)34-28(32)25-19(3)30-23-15-29(4,5)16-24(31)27(23)26(25)21-11-13-22(14-12-21)33-17-20-9-7-6-8-10-20/h6-14,18,25-26H,15-17H2,1-5H3/t25?,26-/m1/s1