cyclopentyl (3S,4R)-4-(2-butoxyphenyl)-2-methyl-5-oxidanylidene-4,6,7,8-tetrahydro-3H-quinoline-3-carboxylate

Systemtic Name: cyclopentyl (3S,4R)-4-(2-butoxyphenyl)-2-methyl-5-oxidanylidene-4,6,7,8-tetrahydro-3H-quinoline-3-carboxylate Openeye Name: cyclopentyl (3S,4R)-4-(2-butoxyphenyl)-2-methyl-5-oxo-4,6,7,8-tetrahydro-3H-quinoline-3-carboxylate CAS Name: (3S,4R)-4-(2-butoxyphenyl)-2-methyl-5-oxo-4,6,7,8-tetrahydro-3H-quinoline-3-carboxylic acid cyclopentyl ester IUPAC Name: cyclopentyl (3S,4R)-4-(2-butoxyphenyl)-2-methyl-5-oxo-4,6,7,8-tetrahydro-3H-quinoline-3-carboxylate Traditional Name: (3S,4R)-4-(2-butoxyphenyl)-5-keto-2-methyl-4,6,7,8-tetrahydro-3H-quinoline-3-carboxylic acid cyclopentyl ester Formula: C26H33NO4 MolecularWeight: 423.54452

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC1=CC=CC=C1C2C(C(=NC3=C2C(=O)CCC3)C)C(=O)OC4CCCC4

Isomeric SMILES

CCCCOC1=CC=CC=C1[C@H]2[C@@H](C(=NC3=C2C(=O)CCC3)C)C(=O)OC4CCCC4

InChI

InChI=1S/C26H33NO4/c1-3-4-16-30-22-15-8-7-12-19(22)24-23(26(29)31-18-10-5-6-11-18)17(2)27-20-13-9-14-21(28)25(20)24/h7-8,12,15,18,23-24H,3-6,9-11,13-14,16H2,1-2H3/t23-,24+/m1/s1