3-[carboxymethyl-[(4-nitrophenyl)methyl]sulfamoyl]benzoic acid

Systemtic Name: 3-[carboxymethyl-[(4-nitrophenyl)methyl]sulfamoyl]benzoic acid Openeye Name: 3-[carboxymethyl-[(4-nitrophenyl)methyl]sulfamoyl]benzoic acid CAS Name: 3-[carboxymethyl-[(4-nitrophenyl)methyl]sulfamoyl]benzoic acid IUPAC Name: 3-[carboxymethyl-[(4-nitrophenyl)methyl]sulfamoyl]benzoic acid Traditional Name: 3-[carboxymethyl-(4-nitrobenzyl)sulfamoyl]benzoic acid Formula: C16H14N2O8S MolecularWeight: 394.35596

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)S(=O)(=O)N(CC2=CC=C(C=C2)[N+](=O)[O-])CC(=O)O)C(=O)O

Isomeric SMILES

C1=CC(=CC(=C1)S(=O)(=O)N(CC2=CC=C(C=C2)[N+](=O)[O-])CC(=O)O)C(=O)O

InChI

InChI=1S/C16H14N2O8S/c19-15(20)10-17(9-11-4-6-13(7-5-11)18(23)24)27(25,26)14-3-1-2-12(8-14)16(21)22/h1-8H,9-10H2,(H,19,20)(H,21,22)