2-[2-[[(4-methylphenyl)sulfonylamino]methyl]phenyl]ethanoic acid

Systemtic Name: 2-[2-[[(4-methylphenyl)sulfonylamino]methyl]phenyl]ethanoic acid Openeye Name: 2-[2-[(p-tolylsulfonylamino)methyl]phenyl]acetic acid CAS Name: 2-[2-[[(4-methylphenyl)sulfonylamino]methyl]phenyl]acetic acid IUPAC Name: 2-[2-[[(4-methylphenyl)sulfonylamino]methyl]phenyl]acetic acid Traditional Name: 2-[2-[(tosylamino)methyl]phenyl]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)NCC2=CC=CC=C2CC(=O)O

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)NCC2=CC=CC=C2CC(=O)O

InChI

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