5-[(4-oxidanidyl-4-oxidanylidene-butyl)sulfamoyl]-2-[(phenylmethyl)amino]benzoate

Systemtic Name: 5-[(4-oxidanidyl-4-oxidanylidene-butyl)sulfamoyl]-2-[(phenylmethyl)amino]benzoate Openeye Name: 2-(benzylamino)-5-[(4-oxido-4-oxo-butyl)sulfamoyl]benzoate CAS Name: 5-[(4-oxido-4-oxobutyl)sulfamoyl]-2-[(phenylmethyl)amino]benzoate IUPAC Name: 2-(benzylamino)-5-[(4-oxido-4-oxobutyl)sulfamoyl]benzoate Traditional Name: 2-(benzylamino)-5-[(4-keto-4-oxido-butyl)sulfamoyl]benzoate Formula: C18H18N2O6S-2 MolecularWeight: 390.41032

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CNC2=C(C=C(C=C2)S(=O)(=O)NCCCC(=O)[O-])C(=O)[O-]

Isomeric SMILES

C1=CC=C(C=C1)CNC2=C(C=C(C=C2)S(=O)(=O)NCCCC(=O)[O-])C(=O)[O-]

InChI

InChI=1S/C18H20N2O6S/c21-17(22)7-4-10-20-27(25,26)14-8-9-16(15(11-14)18(23)24)19-12-13-5-2-1-3-6-13/h1-3,5-6,8-9,11,19-20H,4,7,10,12H2,(H,21,22)(H,23,24)/p-2