diethyl (4R,6R,7S)-5-oxidanylidene-2-propyl-4-pyridin-2-yl-7-thiophen-2-yl-4,6,7,8-tetrahydro-1H-quinoline-3,6-dicarboxylate

Systemtic Name: diethyl (4R,6R,7S)-5-oxidanylidene-2-propyl-4-pyridin-2-yl-7-thiophen-2-yl-4,6,7,8-tetrahydro-1H-quinoline-3,6-dicarboxylate Openeye Name: diethyl (4R,6R,7S)-5-oxo-2-propyl-4-(2-pyridyl)-7-(2-thienyl)-4,6,7,8-tetrahydro-1H-quinoline-3,6-dicarboxylate CAS Name: (4R,6R,7S)-5-oxo-2-propyl-4-(2-pyridinyl)-7-thiophen-2-yl-4,6,7,8-tetrahydro-1H-quinoline-3,6-dicarboxylic acid diethyl ester IUPAC Name: diethyl (4R,6R,7S)-5-oxo-2-propyl-4-pyridin-2-yl-7-thiophen-2-yl-4,6,7,8-tetrahydro-1H-quinoline-3,6-dicarboxylate Traditional Name: (4R,6R,7S)-5-keto-2-propyl-4-(2-pyridyl)-7-(2-thienyl)-4,6,7,8-tetrahydro-1H-quinoline-3,6-dicarboxylic acid diethyl ester Formula: C27H30N2O5S MolecularWeight: 494.6025

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=C(C(C2=C(N1)CC(C(C2=O)C(=O)OCC)C3=CC=CS3)C4=CC=CC=N4)C(=O)OCC

Isomeric SMILES

CCCC1=C([C@@H](C2=C(N1)C[C@@H]([C@H](C2=O)C(=O)OCC)C3=CC=CS3)C4=CC=CC=N4)C(=O)OCC

InChI

InChI=1S/C27H30N2O5S/c1-4-10-18-24(27(32)34-6-3)22(17-11-7-8-13-28-17)23-19(29-18)15-16(20-12-9-14-35-20)21(25(23)30)26(31)33-5-2/h7-9,11-14,16,21-22,29H,4-6,10,15H2,1-3H3/t16-,21-,22-/m1/s1