ethyl 2-[(2,4-dinitrophenyl)carbonylamino]-5-ethanoyl-4-methyl-thiophene-3-carboxylate

Systemtic Name: ethyl 2-[(2,4-dinitrophenyl)carbonylamino]-5-ethanoyl-4-methyl-thiophene-3-carboxylate Openeye Name: ethyl 5-acetyl-2-[(2,4-dinitrobenzoyl)amino]-4-methyl-thiophene-3-carboxylate CAS Name: 5-acetyl-2-[[(2,4-dinitrophenyl)-oxomethyl]amino]-4-methyl-3-thiophenecarboxylic acid ethyl ester IUPAC Name: ethyl 5-acetyl-2-[(2,4-dinitrobenzoyl)amino]-4-methylthiophene-3-carboxylate Traditional Name: 5-acetyl-2-[(2,4-dinitrobenzoyl)amino]-4-methyl-thiophene-3-carboxylic acid ethyl ester Formula: C17H15N3O8S MolecularWeight: 421.3813

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(SC(=C1C)C(=O)C)NC(=O)C2=C(C=C(C=C2)[N+](=O)[O-])[N+](=O)[O-]

Isomeric SMILES

CCOC(=O)C1=C(SC(=C1C)C(=O)C)NC(=O)C2=C(C=C(C=C2)[N+](=O)[O-])[N+](=O)[O-]

InChI

InChI=1S/C17H15N3O8S/c1-4-28-17(23)13-8(2)14(9(3)21)29-16(13)18-15(22)11-6-5-10(19(24)25)7-12(11)20(26)27/h5-7H,4H2,1-3H3,(H,18,22)