2-[[4-(4-oxidanylidenepiperidin-1-yl)phenyl]sulfonyl-propan-2-yl-amino]ethanoate

Systemtic Name: 2-[[4-(4-oxidanylidenepiperidin-1-yl)phenyl]sulfonyl-propan-2-yl-amino]ethanoate Openeye Name: 2-[isopropyl-[4-(4-oxo-1-piperidyl)phenyl]sulfonyl-amino]acetate CAS Name: 2-[[4-(4-oxo-1-piperidinyl)phenyl]sulfonyl-propan-2-ylamino]acetate IUPAC Name: 2-[[4-(4-oxopiperidin-1-yl)phenyl]sulfonyl-propan-2-ylamino]acetate Traditional Name: 2-[isopropyl-[4-(4-ketopiperidino)phenyl]sulfonyl-amino]acetate Formula: C16H21N2O5S- MolecularWeight: 353.41334

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)N(CC(=O)[O-])S(=O)(=O)C1=CC=C(C=C1)N2CCC(=O)CC2

Isomeric SMILES

CC(C)N(CC(=O)[O-])S(=O)(=O)C1=CC=C(C=C1)N2CCC(=O)CC2

InChI

InChI=1S/C16H22N2O5S/c1-12(2)18(11-16(20)21)24(22,23)15-5-3-13(4-6-15)17-9-7-14(19)8-10-17/h3-6,12H,7-11H2,1-2H3,(H,20,21)/p-1