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

Systemtic Name: cyclopentyl (4S)-2,7,7-trimethyl-5-oxidanylidene-4-(2-propan-2-yloxyphenyl)-3,4,6,8-tetrahydroquinoline-3-carboxylate Openeye Name: cyclopentyl (4S)-4-(2-isopropoxyphenyl)-2,7,7-trimethyl-5-oxo-3,4,6,8-tetrahydroquinoline-3-carboxylate CAS Name: (4S)-2,7,7-trimethyl-5-oxo-4-(2-propan-2-yloxyphenyl)-3,4,6,8-tetrahydroquinoline-3-carboxylic acid cyclopentyl ester IUPAC Name: cyclopentyl (4S)-2,7,7-trimethyl-5-oxo-4-(2-propan-2-yloxyphenyl)-3,4,6,8-tetrahydroquinoline-3-carboxylate Traditional Name: (4S)-4-(2-isopropoxyphenyl)-5-keto-2,7,7-trimethyl-3,4,6,8-tetrahydroquinoline-3-carboxylic acid cyclopentyl ester Formula: C27H35NO4 MolecularWeight: 437.5711

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC2=C(C(C1C(=O)OC3CCCC3)C4=CC=CC=C4OC(C)C)C(=O)CC(C2)(C)C

Isomeric SMILES

CC1=NC2=C([C@@H](C1C(=O)OC3CCCC3)C4=CC=CC=C4OC(C)C)C(=O)CC(C2)(C)C

InChI

InChI=1S/C27H35NO4/c1-16(2)31-22-13-9-8-12-19(22)24-23(26(30)32-18-10-6-7-11-18)17(3)28-20-14-27(4,5)15-21(29)25(20)24/h8-9,12-13,16,18,23-24H,6-7,10-11,14-15H2,1-5H3/t23?,24-/m1/s1