diethyl 3-methyl-5-[2-(5-nitro-2-oxidanylidene-pyridin-1-yl)ethanoylamino]thiophene-2,4-dicarboxylate

Systemtic Name: diethyl 3-methyl-5-[2-(5-nitro-2-oxidanylidene-pyridin-1-yl)ethanoylamino]thiophene-2,4-dicarboxylate Openeye Name: diethyl 3-methyl-5-[[2-(5-nitro-2-oxo-1-pyridyl)acetyl]amino]thiophene-2,4-dicarboxylate CAS Name: 3-methyl-5-[[2-(5-nitro-2-oxo-1-pyridinyl)-1-oxoethyl]amino]thiophene-2,4-dicarboxylic acid diethyl ester IUPAC Name: diethyl 3-methyl-5-[[2-(5-nitro-2-oxopyridin-1-yl)acetyl]amino]thiophene-2,4-dicarboxylate Traditional Name: 5-[[2-(2-keto-5-nitro-1-pyridyl)acetyl]amino]-3-methyl-thiophene-2,4-dicarboxylic acid diethyl ester Formula: C18H19N3O8S MolecularWeight: 437.42376

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(SC(=C1C)C(=O)OCC)NC(=O)CN2C=C(C=CC2=O)[N+](=O)[O-]

Isomeric SMILES

CCOC(=O)C1=C(SC(=C1C)C(=O)OCC)NC(=O)CN2C=C(C=CC2=O)[N+](=O)[O-]

InChI

InChI=1S/C18H19N3O8S/c1-4-28-17(24)14-10(3)15(18(25)29-5-2)30-16(14)19-12(22)9-20-8-11(21(26)27)6-7-13(20)23/h6-8H,4-5,9H2,1-3H3,(H,19,22)