4-[(4-methoxycarbonyl-2-nitro-phenyl)sulfonylamino]benzoic acid

Systemtic Name: 4-[(4-methoxycarbonyl-2-nitro-phenyl)sulfonylamino]benzoic acid Openeye Name: 4-[(4-methoxycarbonyl-2-nitro-phenyl)sulfonylamino]benzoic acid CAS Name: 4-[(4-methoxycarbonyl-2-nitrophenyl)sulfonylamino]benzoic acid IUPAC Name: 4-[(4-methoxycarbonyl-2-nitrophenyl)sulfonylamino]benzoic acid Traditional Name: 4-[(4-carbomethoxy-2-nitro-phenyl)sulfonylamino]benzoic acid Formula: C15H12N2O8S MolecularWeight: 380.32938

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC(=C(C=C1)S(=O)(=O)NC2=CC=C(C=C2)C(=O)O)[N+](=O)[O-]

Isomeric SMILES

COC(=O)C1=CC(=C(C=C1)S(=O)(=O)NC2=CC=C(C=C2)C(=O)O)[N+](=O)[O-]

InChI

InChI=1S/C15H12N2O8S/c1-25-15(20)10-4-7-13(12(8-10)17(21)22)26(23,24)16-11-5-2-9(3-6-11)14(18)19/h2-8,16H,1H3,(H,18,19)