cyclopentyl (4R,4aR)-4-(4-methoxy-3-oxidanyl-phenyl)-2-methyl-5-oxidanylidene-4a,6,7,8-tetrahydro-4H-quinoline-3-carboxylate

Systemtic Name: cyclopentyl (4R,4aR)-4-(4-methoxy-3-oxidanyl-phenyl)-2-methyl-5-oxidanylidene-4a,6,7,8-tetrahydro-4H-quinoline-3-carboxylate Openeye Name: cyclopentyl (4R,4aR)-4-(3-hydroxy-4-methoxy-phenyl)-2-methyl-5-oxo-4a,6,7,8-tetrahydro-4H-quinoline-3-carboxylate CAS Name: (4R,4aR)-4-(3-hydroxy-4-methoxyphenyl)-2-methyl-5-oxo-4a,6,7,8-tetrahydro-4H-quinoline-3-carboxylic acid cyclopentyl ester IUPAC Name: cyclopentyl (4R,4aR)-4-(3-hydroxy-4-methoxyphenyl)-2-methyl-5-oxo-4a,6,7,8-tetrahydro-4H-quinoline-3-carboxylate Traditional Name: (4R,4aR)-4-(3-hydroxy-4-methoxy-phenyl)-5-keto-2-methyl-4a,6,7,8-tetrahydro-4H-quinoline-3-carboxylic acid cyclopentyl ester Formula: C23H27NO5 MolecularWeight: 397.46418

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(C2C(=N1)CCCC2=O)C3=CC(=C(C=C3)OC)O)C(=O)OC4CCCC4

Isomeric SMILES

CC1=C([C@H]([C@@H]2C(=N1)CCCC2=O)C3=CC(=C(C=C3)OC)O)C(=O)OC4CCCC4

InChI

InChI=1S/C23H27NO5/c1-13-20(23(27)29-15-6-3-4-7-15)21(14-10-11-19(28-2)18(26)12-14)22-16(24-13)8-5-9-17(22)25/h10-12,15,21-22,26H,3-9H2,1-2H3/t21-,22-/m1/s1