methyl 4-(4-acetyloxy-3-methoxy-phenyl)-2-methylidene-5-oxidanylidene-7-thiophen-2-yl-1,3,4,6,7,8-hexahydroquinoline-3-carboxylate

Systemtic Name: methyl 4-(4-acetyloxy-3-methoxy-phenyl)-2-methylidene-5-oxidanylidene-7-thiophen-2-yl-1,3,4,6,7,8-hexahydroquinoline-3-carboxylate Openeye Name: methyl 4-(4-acetoxy-3-methoxy-phenyl)-2-methylene-5-oxo-7-(2-thienyl)-1,3,4,6,7,8-hexahydroquinoline-3-carboxylate CAS Name: 4-(4-acetyloxy-3-methoxyphenyl)-2-methylene-5-oxo-7-thiophen-2-yl-1,3,4,6,7,8-hexahydroquinoline-3-carboxylic acid methyl ester IUPAC Name: methyl 4-(4-acetyloxy-3-methoxyphenyl)-2-methylidene-5-oxo-7-thiophen-2-yl-1,3,4,6,7,8-hexahydroquinoline-3-carboxylate Traditional Name: 4-(4-acetoxy-3-methoxy-phenyl)-5-keto-2-methylene-7-(2-thienyl)-1,3,4,6,7,8-hexahydroquinoline-3-carboxylic acid methyl ester Formula: C25H25NO6S MolecularWeight: 467.5341

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C25H25NO6S/c1-13-22(25(29)31-4)23(15-7-8-19(32-14(2)27)20(12-15)30-3)24-17(26-13)10-16(11-18(24)28)21-6-5-9-33-21/h5-9,12,16,22-23,26H,1,10-11H2,2-4H3