2-[(phenylmethyl)sulfonylamino]pentanedioate

Systemtic Name: 2-[(phenylmethyl)sulfonylamino]pentanedioate Openeye Name: 2-(benzylsulfonylamino)pentanedioate CAS Name: 2-[(phenylmethyl)sulfonylamino]pentanedioate IUPAC Name: 2-(benzylsulfonylamino)pentanedioate Traditional Name: 2-(benzylsulfonylamino)glutarate Formula: C12H13NO6S-2 MolecularWeight: 299.29972

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CS(=O)(=O)NC(CCC(=O)[O-])C(=O)[O-]

Isomeric SMILES

C1=CC=C(C=C1)CS(=O)(=O)NC(CCC(=O)[O-])C(=O)[O-]

InChI

InChI=1S/C12H15NO6S/c14-11(15)7-6-10(12(16)17)13-20(18,19)8-9-4-2-1-3-5-9/h1-5,10,13H,6-8H2,(H,14,15)(H,16,17)/p-2