4-[2-chloroethyl(methylsulfonyl)amino]benzoic acid

Systemtic Name: 4-[2-chloroethyl(methylsulfonyl)amino]benzoic acid Openeye Name: 4-[2-chloroethyl(methylsulfonyl)amino]benzoic acid CAS Name: 4-[2-chloroethyl(methylsulfonyl)amino]benzoic acid IUPAC Name: 4-[2-chloroethyl(methylsulfonyl)amino]benzoic acid Traditional Name: 4-[2-chloroethyl(mesyl)amino]benzoic acid Formula: C10H12ClNO4S MolecularWeight: 277.72458

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)N(CCCl)C1=CC=C(C=C1)C(=O)O

Isomeric SMILES

CS(=O)(=O)N(CCCl)C1=CC=C(C=C1)C(=O)O

InChI

InChI=1S/C10H12ClNO4S/c1-17(15,16)12(7-6-11)9-4-2-8(3-5-9)10(13)14/h2-5H,6-7H2,1H3,(H,13,14)