2-methoxyethyl 7-(4-ethoxy-3-methoxy-phenyl)-2-methyl-5-oxidanylidene-4-thiophen-2-yl-4,4a,6,7-tetrahydro-1H-quinoline-3-carboxylate

Systemtic Name: 2-methoxyethyl 7-(4-ethoxy-3-methoxy-phenyl)-2-methyl-5-oxidanylidene-4-thiophen-2-yl-4,4a,6,7-tetrahydro-1H-quinoline-3-carboxylate Openeye Name: 2-methoxyethyl 7-(4-ethoxy-3-methoxy-phenyl)-2-methyl-5-oxo-4-(2-thienyl)-4,4a,6,7-tetrahydro-1H-quinoline-3-carboxylate CAS Name: 7-(4-ethoxy-3-methoxyphenyl)-2-methyl-5-oxo-4-thiophen-2-yl-4,4a,6,7-tetrahydro-1H-quinoline-3-carboxylic acid 2-methoxyethyl ester IUPAC Name: 2-methoxyethyl 7-(4-ethoxy-3-methoxyphenyl)-2-methyl-5-oxo-4-thiophen-2-yl-4,4a,6,7-tetrahydro-1H-quinoline-3-carboxylate Traditional Name: 7-(4-ethoxy-3-methoxy-phenyl)-5-keto-2-methyl-4-(2-thienyl)-4,4a,6,7-tetrahydro-1H-quinoline-3-carboxylic acid 2-methoxyethyl ester Formula: C27H31NO6S MolecularWeight: 497.60314

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C(C=C1)C2CC(=O)C3C(C(=C(NC3=C2)C)C(=O)OCCOC)C4=CC=CS4)OC

Isomeric SMILES

CCOC1=C(C=C(C=C1)C2CC(=O)C3C(C(=C(NC3=C2)C)C(=O)OCCOC)C4=CC=CS4)OC

InChI

InChI=1S/C27H31NO6S/c1-5-33-21-9-8-17(15-22(21)32-4)18-13-19-25(20(29)14-18)26(23-7-6-12-35-23)24(16(2)28-19)27(30)34-11-10-31-3/h6-9,12-13,15,18,25-26,28H,5,10-11,14H2,1-4H3