methyl (2S)-2-[3-(4-chlorophenyl)sulfonylpropanoylamino]-3-oxidanyl-propanoate

Systemtic Name: methyl (2S)-2-[3-(4-chlorophenyl)sulfonylpropanoylamino]-3-oxidanyl-propanoate Openeye Name: methyl (2S)-2-[3-(4-chlorophenyl)sulfonylpropanoylamino]-3-hydroxy-propanoate CAS Name: (2S)-2-[[3-(4-chlorophenyl)sulfonyl-1-oxopropyl]amino]-3-hydroxypropanoic acid methyl ester IUPAC Name: methyl (2S)-2-[3-(4-chlorophenyl)sulfonylpropanoylamino]-3-hydroxypropanoate Traditional Name: (2S)-2-[3-(4-chlorophenyl)sulfonylpropanoylamino]-3-hydroxy-propionic acid methyl ester Formula: C13H16ClNO6S MolecularWeight: 349.78724

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C(CO)NC(=O)CCS(=O)(=O)C1=CC=C(C=C1)Cl

Isomeric SMILES

COC(=O)[C@H](CO)NC(=O)CCS(=O)(=O)C1=CC=C(C=C1)Cl

InChI

InChI=1S/C13H16ClNO6S/c1-21-13(18)11(8-16)15-12(17)6-7-22(19,20)10-4-2-9(14)3-5-10/h2-5,11,16H,6-8H2,1H3,(H,15,17)/t11-/m0/s1