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

Systemtic Name: diethyl 4-(1,3-benzodioxol-5-yl)-5-oxidanylidene-2-propyl-7-thiophen-2-yl-4,6,7,8-tetrahydro-1H-quinoline-3,6-dicarboxylate Openeye Name: diethyl 4-(1,3-benzodioxol-5-yl)-5-oxo-2-propyl-7-(2-thienyl)-4,6,7,8-tetrahydro-1H-quinoline-3,6-dicarboxylate CAS Name: 4-(1,3-benzodioxol-5-yl)-5-oxo-2-propyl-7-thiophen-2-yl-4,6,7,8-tetrahydro-1H-quinoline-3,6-dicarboxylic acid diethyl ester IUPAC Name: diethyl 4-(1,3-benzodioxol-5-yl)-5-oxo-2-propyl-7-thiophen-2-yl-4,6,7,8-tetrahydro-1H-quinoline-3,6-dicarboxylate Traditional Name: 4-(1,3-benzodioxol-5-yl)-5-keto-2-propyl-7-(2-thienyl)-4,6,7,8-tetrahydro-1H-quinoline-3,6-dicarboxylic acid diethyl ester Formula: C29H31NO7S MolecularWeight: 537.62394

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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=CC5=C(C=C4)OCO5)C(=O)OCC

Isomeric SMILES

CCCC1=C(C(C2=C(N1)CC(C(C2=O)C(=O)OCC)C3=CC=CS3)C4=CC5=C(C=C4)OCO5)C(=O)OCC

InChI

InChI=1S/C29H31NO7S/c1-4-8-18-26(29(33)35-6-3)23(16-10-11-20-21(13-16)37-15-36-20)25-19(30-18)14-17(22-9-7-12-38-22)24(27(25)31)28(32)34-5-2/h7,9-13,17,23-24,30H,4-6,8,14-15H2,1-3H3