[2-[(3-nitrophenyl)carbonylamino]-2-oxidanylidene-ethyl] 4,5-bis(bromanyl)thiophene-2-carboxylate

Systemtic Name: [2-[(3-nitrophenyl)carbonylamino]-2-oxidanylidene-ethyl] 4,5-bis(bromanyl)thiophene-2-carboxylate Openeye Name: [2-[(3-nitrobenzoyl)amino]-2-oxo-ethyl] 4,5-dibromothiophene-2-carboxylate CAS Name: 4,5-dibromo-2-thiophenecarboxylic acid [2-[[(3-nitrophenyl)-oxomethyl]amino]-2-oxoethyl] ester IUPAC Name: [2-[(3-nitrobenzoyl)amino]-2-oxoethyl] 4,5-dibromothiophene-2-carboxylate Traditional Name: 4,5-dibromothiophene-2-carboxylic acid [2-keto-2-[(3-nitrobenzoyl)amino]ethyl] ester Formula: C14H8Br2N2O6S MolecularWeight: 492.09612

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)[N+](=O)[O-])C(=O)NC(=O)COC(=O)C2=CC(=C(S2)Br)Br

Isomeric SMILES

C1=CC(=CC(=C1)[N+](=O)[O-])C(=O)NC(=O)COC(=O)C2=CC(=C(S2)Br)Br

InChI

InChI=1S/C14H8Br2N2O6S/c15-9-5-10(25-12(9)16)14(21)24-6-11(19)17-13(20)7-2-1-3-8(4-7)18(22)23/h1-5H,6H2,(H,17,19,20)