3-[[(3R)-1-(4-ethanoylphenyl)sulfonylpiperidin-3-yl]carbonylamino]propanoate

Systemtic Name: 3-[[(3R)-1-(4-ethanoylphenyl)sulfonylpiperidin-3-yl]carbonylamino]propanoate Openeye Name: 3-[[(3R)-1-(4-acetylphenyl)sulfonylpiperidine-3-carbonyl]amino]propanoate CAS Name: 3-[[[(3R)-1-(4-acetylphenyl)sulfonyl-3-piperidinyl]-oxomethyl]amino]propanoate IUPAC Name: 3-[[(3R)-1-(4-acetylphenyl)sulfonylpiperidine-3-carbonyl]amino]propanoate Traditional Name: 3-[[(3R)-1-(4-acetylphenyl)sulfonylnipecotoyl]amino]propionate Formula: C17H21N2O6S- MolecularWeight: 381.42344

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C1=CC=C(C=C1)S(=O)(=O)N2CCCC(C2)C(=O)NCCC(=O)[O-]

Isomeric SMILES

CC(=O)C1=CC=C(C=C1)S(=O)(=O)N2CCC[C@H](C2)C(=O)NCCC(=O)[O-]

InChI

InChI=1S/C17H22N2O6S/c1-12(20)13-4-6-15(7-5-13)26(24,25)19-10-2-3-14(11-19)17(23)18-9-8-16(21)22/h4-7,14H,2-3,8-11H2,1H3,(H,18,23)(H,21,22)/p-1/t14-/m1/s1