2-[(4-hydroxyphenyl)amino]ethanoic acid; 4-methylbenzenesulfonic acid

Systemtic Name: 2-[(4-hydroxyphenyl)amino]ethanoic acid; 4-methylbenzenesulfonic acid Openeye Name: 2-(4-hydroxyanilino)acetic acid; 4-methylbenzenesulfonic acid CAS Name: 2-(4-hydroxyanilino)acetic acid; 4-methylbenzenesulfonic acid IUPAC Name: 2-(4-hydroxyanilino)acetic acid; 4-methylbenzenesulfonic acid Traditional Name: 2-(4-hydroxyanilino)acetic acid; tosylic acid Formula: C15H17NO6S MolecularWeight: 339.36358

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)O.C1=CC(=CC=C1NCC(=O)O)O

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)O.C1=CC(=CC=C1NCC(=O)O)O

InChI

InChI=1S/C8H9NO3.C7H8O3S/c10-7-3-1-6(2-4-7)9-5-8(11)12;1-6-2-4-7(5-3-6)11(8,9)10/h1-4,9-10H,5H2,(H,11,12);2-5H,1H3,(H,8,9,10)