propyl 4-(3-methoxy-5-nitro-4-oxidanyl-phenyl)-2-methylidene-5-oxidanylidene-7-thiophen-2-yl-1,3,4,6,7,8-hexahydroquinoline-3-carboxylate

Systemtic Name: propyl 4-(3-methoxy-5-nitro-4-oxidanyl-phenyl)-2-methylidene-5-oxidanylidene-7-thiophen-2-yl-1,3,4,6,7,8-hexahydroquinoline-3-carboxylate Openeye Name: propyl 4-(4-hydroxy-3-methoxy-5-nitro-phenyl)-2-methylene-5-oxo-7-(2-thienyl)-1,3,4,6,7,8-hexahydroquinoline-3-carboxylate CAS Name: 4-(4-hydroxy-3-methoxy-5-nitrophenyl)-2-methylene-5-oxo-7-thiophen-2-yl-1,3,4,6,7,8-hexahydroquinoline-3-carboxylic acid propyl ester IUPAC Name: propyl 4-(4-hydroxy-3-methoxy-5-nitrophenyl)-2-methylidene-5-oxo-7-thiophen-2-yl-1,3,4,6,7,8-hexahydroquinoline-3-carboxylate Traditional Name: 4-(4-hydroxy-3-methoxy-5-nitro-phenyl)-5-keto-2-methylene-7-(2-thienyl)-1,3,4,6,7,8-hexahydroquinoline-3-carboxylic acid propyl ester Formula: C25H26N2O7S MolecularWeight: 498.54814

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Descriptors Computed from Structure

Canonical SMILES:

CCCOC(=O)C1C(C2=C(CC(CC2=O)C3=CC=CS3)NC1=C)C4=CC(=C(C(=C4)OC)O)[N+](=O)[O-]

Isomeric SMILES

CCCOC(=O)C1C(C2=C(CC(CC2=O)C3=CC=CS3)NC1=C)C4=CC(=C(C(=C4)OC)O)[N+](=O)[O-]

InChI

InChI=1S/C25H26N2O7S/c1-4-7-34-25(30)21-13(2)26-16-9-14(20-6-5-8-35-20)11-18(28)23(16)22(21)15-10-17(27(31)32)24(29)19(12-15)33-3/h5-6,8,10,12,14,21-22,26,29H,2,4,7,9,11H2,1,3H3