methyl (4R,7S)-7-(4-ethoxy-3-methoxy-phenyl)-2-methyl-5-oxidanylidene-4-thiophen-2-yl-4a,6,7,8-tetrahydro-4H-quinoline-3-carboxylate

Systemtic Name: methyl (4R,7S)-7-(4-ethoxy-3-methoxy-phenyl)-2-methyl-5-oxidanylidene-4-thiophen-2-yl-4a,6,7,8-tetrahydro-4H-quinoline-3-carboxylate Openeye Name: methyl (4R,7S)-7-(4-ethoxy-3-methoxy-phenyl)-2-methyl-5-oxo-4-(2-thienyl)-4a,6,7,8-tetrahydro-4H-quinoline-3-carboxylate CAS Name: (4R,7S)-7-(4-ethoxy-3-methoxyphenyl)-2-methyl-5-oxo-4-thiophen-2-yl-4a,6,7,8-tetrahydro-4H-quinoline-3-carboxylic acid methyl ester IUPAC Name: methyl (4R,7S)-7-(4-ethoxy-3-methoxyphenyl)-2-methyl-5-oxo-4-thiophen-2-yl-4a,6,7,8-tetrahydro-4H-quinoline-3-carboxylate Traditional Name: (4R,7S)-7-(4-ethoxy-3-methoxy-phenyl)-5-keto-2-methyl-4-(2-thienyl)-4a,6,7,8-tetrahydro-4H-quinoline-3-carboxylic acid methyl ester Formula: C25H27NO5S MolecularWeight: 453.55058

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C(C=C1)C2CC3=NC(=C(C(C3C(=O)C2)C4=CC=CS4)C(=O)OC)C)OC

Isomeric SMILES

CCOC1=C(C=C(C=C1)[C@H]2CC3=NC(=C([C@@H](C3C(=O)C2)C4=CC=CS4)C(=O)OC)C)OC

InChI

InChI=1S/C25H27NO5S/c1-5-31-19-9-8-15(13-20(19)29-3)16-11-17-23(18(27)12-16)24(21-7-6-10-32-21)22(14(2)26-17)25(28)30-4/h6-10,13,16,23-24H,5,11-12H2,1-4H3/t16-,23?,24-/m0/s1