5-methyl-2-[(4-nitrophenyl)carbonylamino]thiophene-3-carboxylic acid

Systemtic Name: 5-methyl-2-[(4-nitrophenyl)carbonylamino]thiophene-3-carboxylic acid Openeye Name: 5-methyl-2-[(4-nitrobenzoyl)amino]thiophene-3-carboxylic acid CAS Name: 5-methyl-2-[[(4-nitrophenyl)-oxomethyl]amino]-3-thiophenecarboxylic acid IUPAC Name: 5-methyl-2-[(4-nitrobenzoyl)amino]thiophene-3-carboxylic acid Traditional Name: 5-methyl-2-[(4-nitrobenzoyl)amino]-3-thenoic acid Formula: C13H10N2O5S MolecularWeight: 306.2939

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(S1)NC(=O)C2=CC=C(C=C2)[N+](=O)[O-])C(=O)O

Isomeric SMILES

CC1=CC(=C(S1)NC(=O)C2=CC=C(C=C2)[N+](=O)[O-])C(=O)O

InChI

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