2-[(5-nitrothiophen-2-yl)carbonylamino]-2-phenyl-ethanoic acid

Systemtic Name: 2-[(5-nitrothiophen-2-yl)carbonylamino]-2-phenyl-ethanoic acid Openeye Name: 2-[(5-nitrothiophene-2-carbonyl)amino]-2-phenyl-acetic acid CAS Name: 2-[[(5-nitro-2-thiophenyl)-oxomethyl]amino]-2-phenylacetic acid IUPAC Name: 2-[(5-nitrothiophene-2-carbonyl)amino]-2-phenylacetic acid Traditional Name: 2-[(5-nitrothiophene-2-carbonyl)amino]-2-phenyl-acetic acid Formula: C13H10N2O5S MolecularWeight: 306.2939

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C(C(=O)O)NC(=O)C2=CC=C(S2)[N+](=O)[O-]

Isomeric SMILES

C1=CC=C(C=C1)C(C(=O)O)NC(=O)C2=CC=C(S2)[N+](=O)[O-]

InChI

InChI=1S/C13H10N2O5S/c16-12(9-6-7-10(21-9)15(19)20)14-11(13(17)18)8-4-2-1-3-5-8/h1-7,11H,(H,14,16)(H,17,18)