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

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

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CSC(=C1NC(=O)C2=CC(=CC=C2)[N+](=O)[O-])C(=O)O

Isomeric SMILES

CC1=CSC(=C1NC(=O)C2=CC(=CC=C2)[N+](=O)[O-])C(=O)O

InChI

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