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

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

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

Canonical SMILES:

C1=CC(=CC=C1CN(CC(=O)O)S(=O)(=O)C2=CC=C(C=C2)C(=O)O)[N+](=O)[O-]


Isomeric SMILES

C1=CC(=CC=C1CN(CC(=O)O)S(=O)(=O)C2=CC=C(C=C2)C(=O)O)[N+](=O)[O-]


InChI

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


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