2-[(4-methylphenyl)sulfonyl-(phenylmethyl)amino]ethanoic acid

Systemtic Name: 2-[(4-methylphenyl)sulfonyl-(phenylmethyl)amino]ethanoic acid Openeye Name: 2-[benzyl(p-tolylsulfonyl)amino]acetic acid CAS Name: 2-[(4-methylphenyl)sulfonyl-(phenylmethyl)amino]acetic acid IUPAC Name: 2-[benzyl-(4-methylphenyl)sulfonylamino]acetic acid Traditional Name: 2-[benzyl(tosyl)amino]acetic acid Formula: C16H17NO4S MolecularWeight: 319.37548

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)N(CC2=CC=CC=C2)CC(=O)O

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)N(CC2=CC=CC=C2)CC(=O)O

InChI

InChI=1S/C16H17NO4S/c1-13-7-9-15(10-8-13)22(20,21)17(12-16(18)19)11-14-5-3-2-4-6-14/h2-10H,11-12H2,1H3,(H,18,19)