(2S)-2-[[(3S)-1-(4-chlorophenyl)sulfonylpiperidin-3-yl]carbonylamino]-2-phenyl-ethanoate

Systemtic Name: (2S)-2-[[(3S)-1-(4-chlorophenyl)sulfonylpiperidin-3-yl]carbonylamino]-2-phenyl-ethanoate Openeye Name: (2S)-2-[[(3S)-1-(4-chlorophenyl)sulfonylpiperidine-3-carbonyl]amino]-2-phenyl-acetate CAS Name: (2S)-2-[[[(3S)-1-(4-chlorophenyl)sulfonyl-3-piperidinyl]-oxomethyl]amino]-2-phenylacetate IUPAC Name: (2S)-2-[[(3S)-1-(4-chlorophenyl)sulfonylpiperidine-3-carbonyl]amino]-2-phenylacetate Traditional Name: (2S)-2-[[(3S)-1-(4-chlorophenyl)sulfonylnipecotoyl]amino]-2-phenyl-acetate Formula: C20H20ClN2O5S- MolecularWeight: 435.9012

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(CN(C1)S(=O)(=O)C2=CC=C(C=C2)Cl)C(=O)NC(C3=CC=CC=C3)C(=O)[O-]

Isomeric SMILES

C1C[C@@H](CN(C1)S(=O)(=O)C2=CC=C(C=C2)Cl)C(=O)N[C@@H](C3=CC=CC=C3)C(=O)[O-]

InChI

InChI=1S/C20H21ClN2O5S/c21-16-8-10-17(11-9-16)29(27,28)23-12-4-7-15(13-23)19(24)22-18(20(25)26)14-5-2-1-3-6-14/h1-3,5-6,8-11,15,18H,4,7,12-13H2,(H,22,24)(H,25,26)/p-1/t15-,18-/m0/s1