2-[(4-bromophenyl)methyl-methylsulfonyl-amino]benzoic acid

Systemtic Name: 2-[(4-bromophenyl)methyl-methylsulfonyl-amino]benzoic acid Openeye Name: 2-[(4-bromophenyl)methyl-methylsulfonyl-amino]benzoic acid CAS Name: 2-[(4-bromophenyl)methyl-methylsulfonylamino]benzoic acid IUPAC Name: 2-[(4-bromophenyl)methyl-methylsulfonylamino]benzoic acid Traditional Name: 2-[(4-bromobenzyl)-mesyl-amino]benzoic acid Formula: C15H14BrNO4S MolecularWeight: 384.24496

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)N(CC1=CC=C(C=C1)Br)C2=CC=CC=C2C(=O)O

Isomeric SMILES

CS(=O)(=O)N(CC1=CC=C(C=C1)Br)C2=CC=CC=C2C(=O)O

InChI

InChI=1S/C15H14BrNO4S/c1-22(20,21)17(10-11-6-8-12(16)9-7-11)14-5-3-2-4-13(14)15(18)19/h2-9H,10H2,1H3,(H,18,19)