3-azanyl-4-[(phenylmethyl)amino]-5-sulfamoyl-benzoic acid

Systemtic Name: 3-azanyl-4-[(phenylmethyl)amino]-5-sulfamoyl-benzoic acid Openeye Name: 3-amino-4-(benzylamino)-5-sulfamoyl-benzoic acid CAS Name: 3-amino-4-[(phenylmethyl)amino]-5-sulfamoylbenzoic acid IUPAC Name: 3-amino-4-(benzylamino)-5-sulfamoylbenzoic acid Traditional Name: 3-amino-4-(benzylamino)-5-sulfamoyl-benzoic acid Formula: C14H15N3O4S MolecularWeight: 321.3516

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CNC2=C(C=C(C=C2S(=O)(=O)N)C(=O)O)N

Isomeric SMILES

C1=CC=C(C=C1)CNC2=C(C=C(C=C2S(=O)(=O)N)C(=O)O)N

InChI

InChI=1S/C14H15N3O4S/c15-11-6-10(14(18)19)7-12(22(16,20)21)13(11)17-8-9-4-2-1-3-5-9/h1-7,17H,8,15H2,(H,18,19)(H2,16,20,21)