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

Systemtic Name: cyclopentyl (4R,7R)-4-(3-chloranyl-5-ethoxy-4-oxidanyl-phenyl)-2-methyl-5-oxidanylidene-7-phenyl-4a,6,7,8-tetrahydro-4H-quinoline-3-carboxylate Openeye Name: cyclopentyl (4R,7R)-4-(3-chloro-5-ethoxy-4-hydroxy-phenyl)-2-methyl-5-oxo-7-phenyl-4a,6,7,8-tetrahydro-4H-quinoline-3-carboxylate CAS Name: (4R,7R)-4-(3-chloro-5-ethoxy-4-hydroxyphenyl)-2-methyl-5-oxo-7-phenyl-4a,6,7,8-tetrahydro-4H-quinoline-3-carboxylic acid cyclopentyl ester IUPAC Name: cyclopentyl (4R,7R)-4-(3-chloro-5-ethoxy-4-hydroxyphenyl)-2-methyl-5-oxo-7-phenyl-4a,6,7,8-tetrahydro-4H-quinoline-3-carboxylate Traditional Name: (4R,7R)-4-(3-chloro-5-ethoxy-4-hydroxy-phenyl)-5-keto-2-methyl-7-phenyl-4a,6,7,8-tetrahydro-4H-quinoline-3-carboxylic acid cyclopentyl ester Formula: C30H32ClNO5 MolecularWeight: 522.03178

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C(=CC(=C1)C2C3C(=NC(=C2C(=O)OC4CCCC4)C)CC(CC3=O)C5=CC=CC=C5)Cl)O

Isomeric SMILES

CCOC1=C(C(=CC(=C1)[C@H]2C3C(=NC(=C2C(=O)OC4CCCC4)C)C[C@H](CC3=O)C5=CC=CC=C5)Cl)O

InChI

InChI=1S/C30H32ClNO5/c1-3-36-25-16-20(13-22(31)29(25)34)27-26(30(35)37-21-11-7-8-12-21)17(2)32-23-14-19(15-24(33)28(23)27)18-9-5-4-6-10-18/h4-6,9-10,13,16,19,21,27-28,34H,3,7-8,11-12,14-15H2,1-2H3/t19-,27-,28?/m1/s1