2-[[4-[(5-nitrothiophen-2-yl)carbonylamino]phenyl]sulfonylamino]ethanoic acid

Systemtic Name: 2-[[4-[(5-nitrothiophen-2-yl)carbonylamino]phenyl]sulfonylamino]ethanoic acid Openeye Name: 2-[[4-[(5-nitrothiophene-2-carbonyl)amino]phenyl]sulfonylamino]acetic acid CAS Name: 2-[[4-[[(5-nitro-2-thiophenyl)-oxomethyl]amino]phenyl]sulfonylamino]acetic acid IUPAC Name: 2-[[4-[(5-nitrothiophene-2-carbonyl)amino]phenyl]sulfonylamino]acetic acid Traditional Name: 2-[[4-[(5-nitrothiophene-2-carbonyl)amino]phenyl]sulfonylamino]acetic acid Formula: C13H11N3O7S2 MolecularWeight: 385.37234

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1NC(=O)C2=CC=C(S2)[N+](=O)[O-])S(=O)(=O)NCC(=O)O

Isomeric SMILES

C1=CC(=CC=C1NC(=O)C2=CC=C(S2)[N+](=O)[O-])S(=O)(=O)NCC(=O)O

InChI

InChI=1S/C13H11N3O7S2/c17-12(18)7-14-25(22,23)9-3-1-8(2-4-9)15-13(19)10-5-6-11(24-10)16(20)21/h1-6,14H,7H2,(H,15,19)(H,17,18)