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

Systemtic Name: 4-methylbenzenesulfonic acid; (phenylmethyl) 2-[(4-hydroxyphenyl)amino]ethanoate Openeye Name: benzyl 2-(4-hydroxyanilino)acetate; 4-methylbenzenesulfonic acid CAS Name: 2-(4-hydroxyanilino)acetic acid (phenylmethyl) ester; 4-methylbenzenesulfonic acid IUPAC Name: benzyl 2-(4-hydroxyanilino)acetate; 4-methylbenzenesulfonic acid Traditional Name: 2-(4-hydroxyanilino)acetic acid benzyl ester; tosylic acid Formula: C22H23NO6S MolecularWeight: 429.48612

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)O.C1=CC=C(C=C1)COC(=O)CNC2=CC=C(C=C2)O

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)O.C1=CC=C(C=C1)COC(=O)CNC2=CC=C(C=C2)O

InChI

InChI=1S/C15H15NO3.C7H8O3S/c17-14-8-6-13(7-9-14)16-10-15(18)19-11-12-4-2-1-3-5-12;1-6-2-4-7(5-3-6)11(8,9)10/h1-9,16-17H,10-11H2;2-5H,1H3,(H,8,9,10)