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

Systemtic Name: 2-[(4-methylphenyl)sulfonyl-(phenylmethyl)amino]-2-phenyl-ethanoic acid Openeye Name: 2-[benzyl(p-tolylsulfonyl)amino]-2-phenyl-acetic acid CAS Name: 2-[(4-methylphenyl)sulfonyl-(phenylmethyl)amino]-2-phenylacetic acid IUPAC Name: 2-[benzyl-(4-methylphenyl)sulfonylamino]-2-phenylacetic acid Traditional Name: 2-[benzyl(tosyl)amino]-2-phenyl-acetic acid Formula: C22H21NO4S MolecularWeight: 395.47144

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)N(CC2=CC=CC=C2)C(C3=CC=CC=C3)C(=O)O

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)N(CC2=CC=CC=C2)C(C3=CC=CC=C3)C(=O)O

InChI

InChI=1S/C22H21NO4S/c1-17-12-14-20(15-13-17)28(26,27)23(16-18-8-4-2-5-9-18)21(22(24)25)19-10-6-3-7-11-19/h2-15,21H,16H2,1H3,(H,24,25)