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

Systemtic Name: 3-[(3-methyl-4-nitro-phenyl)carbonylamino]thiophene-2-carboxylate Openeye Name: 3-[(3-methyl-4-nitro-benzoyl)amino]thiophene-2-carboxylate CAS Name: 3-[[(3-methyl-4-nitrophenyl)-oxomethyl]amino]-2-thiophenecarboxylate IUPAC Name: 3-[(3-methyl-4-nitrobenzoyl)amino]thiophene-2-carboxylate Traditional Name: 3-[(3-methyl-4-nitro-benzoyl)amino]-2-thenoate Formula: C13H9N2O5S- MolecularWeight: 305.28596

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)C(=O)NC2=C(SC=C2)C(=O)[O-])[N+](=O)[O-]

Isomeric SMILES

CC1=C(C=CC(=C1)C(=O)NC2=C(SC=C2)C(=O)[O-])[N+](=O)[O-]

InChI

InChI=1S/C13H10N2O5S/c1-7-6-8(2-3-10(7)15(19)20)12(16)14-9-4-5-21-11(9)13(17)18/h2-6H,1H3,(H,14,16)(H,17,18)/p-1