3-[1-(cyclohexylamino)-1-oxidanylidene-propan-2-yl]sulfanylpropanoic acid

Systemtic Name: 3-[1-(cyclohexylamino)-1-oxidanylidene-propan-2-yl]sulfanylpropanoic acid Openeye Name: 3-[2-(cyclohexylamino)-1-methyl-2-oxo-ethyl]sulfanylpropanoic acid CAS Name: 3-[[1-(cyclohexylamino)-1-oxopropan-2-yl]thio]propanoic acid IUPAC Name: 3-[1-(cyclohexylamino)-1-oxopropan-2-yl]sulfanylpropanoic acid Traditional Name: 3-[[2-(cyclohexylamino)-2-keto-1-methyl-ethyl]thio]propionic acid Formula: C12H21NO3S MolecularWeight: 259.36504

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC1CCCCC1)SCCC(=O)O

Isomeric SMILES

CC(C(=O)NC1CCCCC1)SCCC(=O)O

InChI

InChI=1S/C12H21NO3S/c1-9(17-8-7-11(14)15)12(16)13-10-5-3-2-4-6-10/h9-10H,2-8H2,1H3,(H,13,16)(H,14,15)