4-[[(2-azanyl-5-bromanyl-phenyl)sulfonylamino]methyl]benzoic acid

Systemtic Name: 4-[[(2-azanyl-5-bromanyl-phenyl)sulfonylamino]methyl]benzoic acid Openeye Name: 4-[[(2-amino-5-bromo-phenyl)sulfonylamino]methyl]benzoic acid CAS Name: 4-[[(2-amino-5-bromophenyl)sulfonylamino]methyl]benzoic acid IUPAC Name: 4-[[(2-amino-5-bromophenyl)sulfonylamino]methyl]benzoic acid Traditional Name: 4-[[(2-amino-5-bromo-phenyl)sulfonylamino]methyl]benzoic acid Formula: C14H13BrN2O4S MolecularWeight: 385.23302

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1CNS(=O)(=O)C2=C(C=CC(=C2)Br)N)C(=O)O

Isomeric SMILES

C1=CC(=CC=C1CNS(=O)(=O)C2=C(C=CC(=C2)Br)N)C(=O)O

InChI

InChI=1S/C14H13BrN2O4S/c15-11-5-6-12(16)13(7-11)22(20,21)17-8-9-1-3-10(4-2-9)14(18)19/h1-7,17H,8,16H2,(H,18,19)