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

Systemtic Name: cyclopentyl 4-(3-ethoxy-4-oxidanyl-phenyl)-2-methylidene-5-oxidanylidene-7-thiophen-2-yl-1,3,4,6,7,8-hexahydroquinoline-3-carboxylate Openeye Name: cyclopentyl 4-(3-ethoxy-4-hydroxy-phenyl)-2-methylene-5-oxo-7-(2-thienyl)-1,3,4,6,7,8-hexahydroquinoline-3-carboxylate CAS Name: 4-(3-ethoxy-4-hydroxyphenyl)-2-methylene-5-oxo-7-thiophen-2-yl-1,3,4,6,7,8-hexahydroquinoline-3-carboxylic acid cyclopentyl ester IUPAC Name: cyclopentyl 4-(3-ethoxy-4-hydroxyphenyl)-2-methylidene-5-oxo-7-thiophen-2-yl-1,3,4,6,7,8-hexahydroquinoline-3-carboxylate Traditional Name: 4-(3-ethoxy-4-hydroxy-phenyl)-5-keto-2-methylene-7-(2-thienyl)-1,3,4,6,7,8-hexahydroquinoline-3-carboxylic acid cyclopentyl ester Formula: C28H31NO5S MolecularWeight: 493.61444

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=CC(=C1)C2C(C(=C)NC3=C2C(=O)CC(C3)C4=CC=CS4)C(=O)OC5CCCC5)O

Isomeric SMILES

CCOC1=C(C=CC(=C1)C2C(C(=C)NC3=C2C(=O)CC(C3)C4=CC=CS4)C(=O)OC5CCCC5)O

InChI

InChI=1S/C28H31NO5S/c1-3-33-23-15-17(10-11-21(23)30)26-25(28(32)34-19-7-4-5-8-19)16(2)29-20-13-18(14-22(31)27(20)26)24-9-6-12-35-24/h6,9-12,15,18-19,25-26,29-30H,2-5,7-8,13-14H2,1H3