3-methyl-5-[(3-nitrophenyl)carbonylamino]thiophene-2-carboxylate

Systemtic Name: 3-methyl-5-[(3-nitrophenyl)carbonylamino]thiophene-2-carboxylate Openeye Name: 3-methyl-5-[(3-nitrobenzoyl)amino]thiophene-2-carboxylate CAS Name: 3-methyl-5-[[(3-nitrophenyl)-oxomethyl]amino]-2-thiophenecarboxylate IUPAC Name: 3-methyl-5-[(3-nitrobenzoyl)amino]thiophene-2-carboxylate Traditional Name: 3-methyl-5-[(3-nitrobenzoyl)amino]-2-thenoate Formula: C13H9N2O5S- MolecularWeight: 305.28596

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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