2-methylpropyl (4R,7R)-7-(3,4-dimethoxyphenyl)-2-methyl-5-oxidanylidene-4-thiophen-2-yl-4,6,7,8-tetrahydro-3H-quinoline-3-carboxylate

Systemtic Name: 2-methylpropyl (4R,7R)-7-(3,4-dimethoxyphenyl)-2-methyl-5-oxidanylidene-4-thiophen-2-yl-4,6,7,8-tetrahydro-3H-quinoline-3-carboxylate Openeye Name: isobutyl (4R,7R)-7-(3,4-dimethoxyphenyl)-2-methyl-5-oxo-4-(2-thienyl)-4,6,7,8-tetrahydro-3H-quinoline-3-carboxylate CAS Name: (4R,7R)-7-(3,4-dimethoxyphenyl)-2-methyl-5-oxo-4-thiophen-2-yl-4,6,7,8-tetrahydro-3H-quinoline-3-carboxylic acid 2-methylpropyl ester IUPAC Name: 2-methylpropyl (4R,7R)-7-(3,4-dimethoxyphenyl)-2-methyl-5-oxo-4-thiophen-2-yl-4,6,7,8-tetrahydro-3H-quinoline-3-carboxylate Traditional Name: (4R,7R)-7-(3,4-dimethoxyphenyl)-5-keto-2-methyl-4-(2-thienyl)-4,6,7,8-tetrahydro-3H-quinoline-3-carboxylic acid isobutyl ester Formula: C27H31NO5S MolecularWeight: 481.60374

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC2=C(C(C1C(=O)OCC(C)C)C3=CC=CS3)C(=O)CC(C2)C4=CC(=C(C=C4)OC)OC

Isomeric SMILES

CC1=NC2=C([C@@H](C1C(=O)OCC(C)C)C3=CC=CS3)C(=O)C[C@@H](C2)C4=CC(=C(C=C4)OC)OC

InChI

InChI=1S/C27H31NO5S/c1-15(2)14-33-27(30)24-16(3)28-19-11-18(17-8-9-21(31-4)22(13-17)32-5)12-20(29)25(19)26(24)23-7-6-10-34-23/h6-10,13,15,18,24,26H,11-12,14H2,1-5H3/t18-,24?,26-/m1/s1