2-[(3-methylphenyl)methyl-(4-methylphenyl)sulfonyl-amino]ethanoic acid

Systemtic Name: 2-[(3-methylphenyl)methyl-(4-methylphenyl)sulfonyl-amino]ethanoic acid Openeye Name: 2-[m-tolylmethyl(p-tolylsulfonyl)amino]acetic acid CAS Name: 2-[(3-methylphenyl)methyl-(4-methylphenyl)sulfonylamino]acetic acid IUPAC Name: 2-[(3-methylphenyl)methyl-(4-methylphenyl)sulfonylamino]acetic acid Traditional Name: 2-[(3-methylbenzyl)-tosyl-amino]acetic acid Formula: C17H19NO4S MolecularWeight: 333.40206

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H19NO4S/c1-13-6-8-16(9-7-13)23(21,22)18(12-17(19)20)11-15-5-3-4-14(2)10-15/h3-10H,11-12H2,1-2H3,(H,19,20)