methyl 3-[(4-chloranyl-3-nitro-phenyl)carbonylamino]thiophene-2-carboxylate

Systemtic Name: methyl 3-[(4-chloranyl-3-nitro-phenyl)carbonylamino]thiophene-2-carboxylate Openeye Name: methyl 3-[(4-chloro-3-nitro-benzoyl)amino]thiophene-2-carboxylate CAS Name: 3-[[(4-chloro-3-nitrophenyl)-oxomethyl]amino]-2-thiophenecarboxylic acid methyl ester IUPAC Name: methyl 3-[(4-chloro-3-nitrobenzoyl)amino]thiophene-2-carboxylate Traditional Name: 3-[(4-chloro-3-nitro-benzoyl)amino]thiophene-2-carboxylic acid methyl ester Formula: C13H9ClN2O5S MolecularWeight: 340.73896

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=C(C=CS1)NC(=O)C2=CC(=C(C=C2)Cl)[N+](=O)[O-]

Isomeric SMILES

COC(=O)C1=C(C=CS1)NC(=O)C2=CC(=C(C=C2)Cl)[N+](=O)[O-]

InChI

InChI=1S/C13H9ClN2O5S/c1-21-13(18)11-9(4-5-22-11)15-12(17)7-2-3-8(14)10(6-7)16(19)20/h2-6H,1H3,(H,15,17)