cyclopentyl 4-(4-acetyloxyphenyl)-2-methylidene-5-oxidanylidene-7-thiophen-2-yl-1,3,4,6,7,8-hexahydroquinoline-3-carboxylate

Systemtic Name: cyclopentyl 4-(4-acetyloxyphenyl)-2-methylidene-5-oxidanylidene-7-thiophen-2-yl-1,3,4,6,7,8-hexahydroquinoline-3-carboxylate Openeye Name: cyclopentyl 4-(4-acetoxyphenyl)-2-methylene-5-oxo-7-(2-thienyl)-1,3,4,6,7,8-hexahydroquinoline-3-carboxylate CAS Name: 4-(4-acetyloxyphenyl)-2-methylene-5-oxo-7-thiophen-2-yl-1,3,4,6,7,8-hexahydroquinoline-3-carboxylic acid cyclopentyl ester IUPAC Name: cyclopentyl 4-(4-acetyloxyphenyl)-2-methylidene-5-oxo-7-thiophen-2-yl-1,3,4,6,7,8-hexahydroquinoline-3-carboxylate Traditional Name: 4-(4-acetoxyphenyl)-5-keto-2-methylene-7-(2-thienyl)-1,3,4,6,7,8-hexahydroquinoline-3-carboxylic acid cyclopentyl ester Formula: C28H29NO5S MolecularWeight: 491.59856

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)OC1=CC=C(C=C1)C2C(C(=C)NC3=C2C(=O)CC(C3)C4=CC=CS4)C(=O)OC5CCCC5

Isomeric SMILES

CC(=O)OC1=CC=C(C=C1)C2C(C(=C)NC3=C2C(=O)CC(C3)C4=CC=CS4)C(=O)OC5CCCC5

InChI

InChI=1S/C28H29NO5S/c1-16-25(28(32)34-20-6-3-4-7-20)26(18-9-11-21(12-10-18)33-17(2)30)27-22(29-16)14-19(15-23(27)31)24-8-5-13-35-24/h5,8-13,19-20,25-26,29H,1,3-4,6-7,14-15H2,2H3