6-[(3-methylsulfonylphenyl)carbonylamino]hexanoate

Systemtic Name: 6-[(3-methylsulfonylphenyl)carbonylamino]hexanoate Openeye Name: 6-[(3-methylsulfonylbenzoyl)amino]hexanoate CAS Name: 6-[[(3-methylsulfonylphenyl)-oxomethyl]amino]hexanoate IUPAC Name: 6-[(3-methylsulfonylbenzoyl)amino]hexanoate Traditional Name: 6-[(3-mesylbenzoyl)amino]hexanoate Formula: C14H18NO5S- MolecularWeight: 312.36142

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)C1=CC=CC(=C1)C(=O)NCCCCCC(=O)[O-]

Isomeric SMILES

CS(=O)(=O)C1=CC=CC(=C1)C(=O)NCCCCCC(=O)[O-]

InChI

InChI=1S/C14H19NO5S/c1-21(19,20)12-7-5-6-11(10-12)14(18)15-9-4-2-3-8-13(16)17/h5-7,10H,2-4,8-9H2,1H3,(H,15,18)(H,16,17)/p-1