dimethyl 5-[(3,5-dinitrophenyl)carbonylamino]-3-methyl-thiophene-2,4-dicarboxylate

Systemtic Name: dimethyl 5-[(3,5-dinitrophenyl)carbonylamino]-3-methyl-thiophene-2,4-dicarboxylate Openeye Name: dimethyl 5-[(3,5-dinitrobenzoyl)amino]-3-methyl-thiophene-2,4-dicarboxylate CAS Name: 5-[[(3,5-dinitrophenyl)-oxomethyl]amino]-3-methylthiophene-2,4-dicarboxylic acid dimethyl ester IUPAC Name: dimethyl 5-[(3,5-dinitrobenzoyl)amino]-3-methylthiophene-2,4-dicarboxylate Traditional Name: 5-[(3,5-dinitrobenzoyl)amino]-3-methyl-thiophene-2,4-dicarboxylic acid dimethyl ester Formula: C16H13N3O9S MolecularWeight: 423.35412

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC(=C1C(=O)OC)NC(=O)C2=CC(=CC(=C2)[N+](=O)[O-])[N+](=O)[O-])C(=O)OC

Isomeric SMILES

CC1=C(SC(=C1C(=O)OC)NC(=O)C2=CC(=CC(=C2)[N+](=O)[O-])[N+](=O)[O-])C(=O)OC

InChI

InChI=1S/C16H13N3O9S/c1-7-11(15(21)27-2)14(29-12(7)16(22)28-3)17-13(20)8-4-9(18(23)24)6-10(5-8)19(25)26/h4-6H,1-3H3,(H,17,20)