ethyl 4-(4-cyclopentyloxyphenyl)-7,7-dimethyl-5-oxidanylidene-2-phenyl-1,4,6,8-tetrahydroquinoline-3-carboxylate

Systemtic Name: ethyl 4-(4-cyclopentyloxyphenyl)-7,7-dimethyl-5-oxidanylidene-2-phenyl-1,4,6,8-tetrahydroquinoline-3-carboxylate Openeye Name: ethyl 4-[4-(cyclopentoxy)phenyl]-7,7-dimethyl-5-oxo-2-phenyl-1,4,6,8-tetrahydroquinoline-3-carboxylate CAS Name: 4-(4-cyclopentyloxyphenyl)-7,7-dimethyl-5-oxo-2-phenyl-1,4,6,8-tetrahydroquinoline-3-carboxylic acid ethyl ester IUPAC Name: ethyl 4-(4-cyclopentyloxyphenyl)-7,7-dimethyl-5-oxo-2-phenyl-1,4,6,8-tetrahydroquinoline-3-carboxylate Traditional Name: 4-[4-(cyclopentoxy)phenyl]-5-keto-7,7-dimethyl-2-phenyl-1,4,6,8-tetrahydroquinoline-3-carboxylic acid ethyl ester Formula: C31H35NO4 MolecularWeight: 485.6139

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(NC2=C(C1C3=CC=C(C=C3)OC4CCCC4)C(=O)CC(C2)(C)C)C5=CC=CC=C5

Isomeric SMILES

CCOC(=O)C1=C(NC2=C(C1C3=CC=C(C=C3)OC4CCCC4)C(=O)CC(C2)(C)C)C5=CC=CC=C5

InChI

InChI=1S/C31H35NO4/c1-4-35-30(34)28-26(20-14-16-23(17-15-20)36-22-12-8-9-13-22)27-24(18-31(2,3)19-25(27)33)32-29(28)21-10-6-5-7-11-21/h5-7,10-11,14-17,22,26,32H,4,8-9,12-13,18-19H2,1-3H3