2-[[1-(phenylsulfonyl)piperidin-4-yl]carbonylamino]ethanoate

Systemtic Name: 2-[[1-(phenylsulfonyl)piperidin-4-yl]carbonylamino]ethanoate Openeye Name: 2-[[1-(benzenesulfonyl)piperidine-4-carbonyl]amino]acetate CAS Name: 2-[[[1-(benzenesulfonyl)-4-piperidinyl]-oxomethyl]amino]acetate IUPAC Name: 2-[[1-(benzenesulfonyl)piperidine-4-carbonyl]amino]acetate Traditional Name: 2-[(1-besylisonipecotoyl)amino]acetate Formula: C14H17N2O5S- MolecularWeight: 325.36018

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1C(=O)NCC(=O)[O-])S(=O)(=O)C2=CC=CC=C2

Isomeric SMILES

C1CN(CCC1C(=O)NCC(=O)[O-])S(=O)(=O)C2=CC=CC=C2

InChI

InChI=1S/C14H18N2O5S/c17-13(18)10-15-14(19)11-6-8-16(9-7-11)22(20,21)12-4-2-1-3-5-12/h1-5,11H,6-10H2,(H,15,19)(H,17,18)/p-1