6-[(phenylmethyl)-(phenylsulfonyl)amino]hexanoic acid

Systemtic Name: 6-[(phenylmethyl)-(phenylsulfonyl)amino]hexanoic acid Openeye Name: 6-[benzenesulfonyl(benzyl)amino]hexanoic acid CAS Name: 6-[benzenesulfonyl-(phenylmethyl)amino]hexanoic acid IUPAC Name: 6-[benzenesulfonyl(benzyl)amino]hexanoic acid Traditional Name: 6-[benzyl(besyl)amino]hexanoic acid Formula: C19H23NO4S MolecularWeight: 361.45522

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CN(CCCCCC(=O)O)S(=O)(=O)C2=CC=CC=C2

Isomeric SMILES

C1=CC=C(C=C1)CN(CCCCCC(=O)O)S(=O)(=O)C2=CC=CC=C2

InChI

InChI=1S/C19H23NO4S/c21-19(22)14-8-3-9-15-20(16-17-10-4-1-5-11-17)25(23,24)18-12-6-2-7-13-18/h1-2,4-7,10-13H,3,8-9,14-16H2,(H,21,22)