ethyl 2-[[(3S)-3-[[(phenylmethyl)sulfonylamino]methyl]piperidin-1-yl]carbonylamino]ethanoate

Systemtic Name: ethyl 2-[[(3S)-3-[[(phenylmethyl)sulfonylamino]methyl]piperidin-1-yl]carbonylamino]ethanoate Openeye Name: ethyl 2-[[(3S)-3-[(benzylsulfonylamino)methyl]piperidine-1-carbonyl]amino]acetate CAS Name: 2-[[oxo-[(3S)-3-[[(phenylmethyl)sulfonylamino]methyl]-1-piperidinyl]methyl]amino]acetic acid ethyl ester IUPAC Name: ethyl 2-[[(3S)-3-[(benzylsulfonylamino)methyl]piperidine-1-carbonyl]amino]acetate Traditional Name: 2-[[(3S)-3-[(benzylsulfonylamino)methyl]piperidine-1-carbonyl]amino]acetic acid ethyl ester Formula: C18H27N3O5S MolecularWeight: 397.48908

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CNC(=O)N1CCCC(C1)CNS(=O)(=O)CC2=CC=CC=C2

Isomeric SMILES

CCOC(=O)CNC(=O)N1CCC[C@@H](C1)CNS(=O)(=O)CC2=CC=CC=C2

InChI

InChI=1S/C18H27N3O5S/c1-2-26-17(22)12-19-18(23)21-10-6-9-16(13-21)11-20-27(24,25)14-15-7-4-3-5-8-15/h3-5,7-8,16,20H,2,6,9-14H2,1H3,(H,19,23)/t16-/m1/s1