methyl 2-[(2,4-dinitrophenyl)carbonylamino]-4-phenyl-thiophene-3-carboxylate

Systemtic Name: methyl 2-[(2,4-dinitrophenyl)carbonylamino]-4-phenyl-thiophene-3-carboxylate Openeye Name: methyl 2-[(2,4-dinitrobenzoyl)amino]-4-phenyl-thiophene-3-carboxylate CAS Name: 2-[[(2,4-dinitrophenyl)-oxomethyl]amino]-4-phenyl-3-thiophenecarboxylic acid methyl ester IUPAC Name: methyl 2-[(2,4-dinitrobenzoyl)amino]-4-phenylthiophene-3-carboxylate Traditional Name: 2-[(2,4-dinitrobenzoyl)amino]-4-phenyl-thiophene-3-carboxylic acid methyl ester Formula: C19H13N3O7S MolecularWeight: 427.38742

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=C(SC=C1C2=CC=CC=C2)NC(=O)C3=C(C=C(C=C3)[N+](=O)[O-])[N+](=O)[O-]

Isomeric SMILES

COC(=O)C1=C(SC=C1C2=CC=CC=C2)NC(=O)C3=C(C=C(C=C3)[N+](=O)[O-])[N+](=O)[O-]

InChI

InChI=1S/C19H13N3O7S/c1-29-19(24)16-14(11-5-3-2-4-6-11)10-30-18(16)20-17(23)13-8-7-12(21(25)26)9-15(13)22(27)28/h2-10H,1H3,(H,20,23)