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

Systemtic Name: phenethyl (4S)-2,7,7-trimethyl-5-oxidanylidene-4-(4-phenylmethoxyphenyl)-3,4,6,8-tetrahydroquinoline-3-carboxylate Openeye Name: phenethyl (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 phenethyl ester IUPAC Name: phenethyl (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 phenethyl ester Formula: C34H35NO4 MolecularWeight: 521.646

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC2=C(C(C1C(=O)OCCC3=CC=CC=C3)C4=CC=C(C=C4)OCC5=CC=CC=C5)C(=O)CC(C2)(C)C

Isomeric SMILES

CC1=NC2=C([C@@H](C1C(=O)OCCC3=CC=CC=C3)C4=CC=C(C=C4)OCC5=CC=CC=C5)C(=O)CC(C2)(C)C

InChI

InChI=1S/C34H35NO4/c1-23-30(33(37)38-19-18-24-10-6-4-7-11-24)31(32-28(35-23)20-34(2,3)21-29(32)36)26-14-16-27(17-15-26)39-22-25-12-8-5-9-13-25/h4-17,30-31H,18-22H2,1-3H3/t30?,31-/m1/s1