4-[[1-(phenylsulfonyl)piperidin-4-yl]carbonylamino]butanoate

Systemtic Name: 4-[[1-(phenylsulfonyl)piperidin-4-yl]carbonylamino]butanoate Openeye Name: 4-[[1-(benzenesulfonyl)piperidine-4-carbonyl]amino]butanoate CAS Name: 4-[[[1-(benzenesulfonyl)-4-piperidinyl]-oxomethyl]amino]butanoate IUPAC Name: 4-[[1-(benzenesulfonyl)piperidine-4-carbonyl]amino]butanoate Traditional Name: 4-[(1-besylisonipecotoyl)amino]butyrate Formula: C16H21N2O5S- MolecularWeight: 353.41334

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H22N2O5S/c19-15(20)7-4-10-17-16(21)13-8-11-18(12-9-13)24(22,23)14-5-2-1-3-6-14/h1-3,5-6,13H,4,7-12H2,(H,17,21)(H,19,20)/p-1