[2-[(2R)-2-aminocarbonylpiperidin-1-yl]-2-oxidanylidene-ethyl] 2-[(4-fluorophenyl)sulfonyl-methyl-amino]ethanoate

Systemtic Name: [2-[(2R)-2-aminocarbonylpiperidin-1-yl]-2-oxidanylidene-ethyl] 2-[(4-fluorophenyl)sulfonyl-methyl-amino]ethanoate Openeye Name: [2-[(2R)-2-carbamoyl-1-piperidyl]-2-oxo-ethyl] 2-[(4-fluorophenyl)sulfonyl-methyl-amino]acetate CAS Name: 2-[(4-fluorophenyl)sulfonyl-methylamino]acetic acid [2-[(2R)-2-carbamoyl-1-piperidinyl]-2-oxoethyl] ester IUPAC Name: [2-[(2R)-2-carbamoylpiperidin-1-yl]-2-oxoethyl] 2-[(4-fluorophenyl)sulfonyl-methylamino]acetate Traditional Name: 2-[(4-fluorophenyl)sulfonyl-methyl-amino]acetic acid [2-[(2R)-2-carbamoylpiperidino]-2-keto-ethyl] ester Formula: C17H22FN3O6S MolecularWeight: 415.436483

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Descriptors Computed from Structure

Canonical SMILES:

CN(CC(=O)OCC(=O)N1CCCCC1C(=O)N)S(=O)(=O)C2=CC=C(C=C2)F

Isomeric SMILES

CN(CC(=O)OCC(=O)N1CCCC[C@@H]1C(=O)N)S(=O)(=O)C2=CC=C(C=C2)F

InChI

InChI=1S/C17H22FN3O6S/c1-20(28(25,26)13-7-5-12(18)6-8-13)10-16(23)27-11-15(22)21-9-3-2-4-14(21)17(19)24/h5-8,14H,2-4,9-11H2,1H3,(H2,19,24)/t14-/m1/s1