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

Systemtic Name: 2-ethoxyethyl 4-(4-methoxy-3-oxidanyl-phenyl)-2-methyl-5-oxidanylidene-7-thiophen-2-yl-4,4a,6,7-tetrahydro-1H-quinoline-3-carboxylate Openeye Name: 2-ethoxyethyl 4-(3-hydroxy-4-methoxy-phenyl)-2-methyl-5-oxo-7-(2-thienyl)-4,4a,6,7-tetrahydro-1H-quinoline-3-carboxylate CAS Name: 4-(3-hydroxy-4-methoxyphenyl)-2-methyl-5-oxo-7-thiophen-2-yl-4,4a,6,7-tetrahydro-1H-quinoline-3-carboxylic acid 2-ethoxyethyl ester IUPAC Name: 2-ethoxyethyl 4-(3-hydroxy-4-methoxyphenyl)-2-methyl-5-oxo-7-thiophen-2-yl-4,4a,6,7-tetrahydro-1H-quinoline-3-carboxylate Traditional Name: 4-(3-hydroxy-4-methoxy-phenyl)-5-keto-2-methyl-7-(2-thienyl)-4,4a,6,7-tetrahydro-1H-quinoline-3-carboxylic acid 2-ethoxyethyl ester Formula: C26H29NO6S MolecularWeight: 483.57656

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Descriptors Computed from Structure

Canonical SMILES:

CCOCCOC(=O)C1=C(NC2=CC(CC(=O)C2C1C3=CC(=C(C=C3)OC)O)C4=CC=CS4)C

Isomeric SMILES

CCOCCOC(=O)C1=C(NC2=CC(CC(=O)C2C1C3=CC(=C(C=C3)OC)O)C4=CC=CS4)C

InChI

InChI=1S/C26H29NO6S/c1-4-32-9-10-33-26(30)23-15(2)27-18-12-17(22-6-5-11-34-22)14-20(29)25(18)24(23)16-7-8-21(31-3)19(28)13-16/h5-8,11-13,17,24-25,27-28H,4,9-10,14H2,1-3H3