(phenylmethyl) 6-[(4-methylphenyl)sulfonylamino]hexanoate

Systemtic Name: (phenylmethyl) 6-[(4-methylphenyl)sulfonylamino]hexanoate Openeye Name: benzyl 6-(p-tolylsulfonylamino)hexanoate CAS Name: 6-[(4-methylphenyl)sulfonylamino]hexanoic acid (phenylmethyl) ester IUPAC Name: benzyl 6-[(4-methylphenyl)sulfonylamino]hexanoate Traditional Name: 6-(tosylamino)hexanoic acid benzyl ester Formula: C20H25NO4S MolecularWeight: 375.4818

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)NCCCCCC(=O)OCC2=CC=CC=C2

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)NCCCCCC(=O)OCC2=CC=CC=C2

InChI

InChI=1S/C20H25NO4S/c1-17-11-13-19(14-12-17)26(23,24)21-15-7-3-6-10-20(22)25-16-18-8-4-2-5-9-18/h2,4-5,8-9,11-14,21H,3,6-7,10,15-16H2,1H3