4-chloranyl-2-[(phenylmethyl)amino]-5-sulfamoyl-benzoic acid

Systemtic Name: 4-chloranyl-2-[(phenylmethyl)amino]-5-sulfamoyl-benzoic acid Openeye Name: 2-(benzylamino)-4-chloro-5-sulfamoyl-benzoic acid CAS Name: 4-chloro-2-[(phenylmethyl)amino]-5-sulfamoylbenzoic acid IUPAC Name: 2-(benzylamino)-4-chloro-5-sulfamoylbenzoic acid Traditional Name: 2-(benzylamino)-4-chloro-5-sulfamoyl-benzoic acid Formula: C14H13ClN2O4S MolecularWeight: 340.78202

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CNC2=CC(=C(C=C2C(=O)O)S(=O)(=O)N)Cl

Isomeric SMILES

C1=CC=C(C=C1)CNC2=CC(=C(C=C2C(=O)O)S(=O)(=O)N)Cl

InChI

InChI=1S/C14H13ClN2O4S/c15-11-7-12(17-8-9-4-2-1-3-5-9)10(14(18)19)6-13(11)22(16,20)21/h1-7,17H,8H2,(H,18,19)(H2,16,20,21)