2-[3-(cyclohexylamino)-3-oxidanylidene-propyl]sulfanylpropanoic acid

Systemtic Name: 2-[3-(cyclohexylamino)-3-oxidanylidene-propyl]sulfanylpropanoic acid Openeye Name: 2-[3-(cyclohexylamino)-3-oxo-propyl]sulfanylpropanoic acid CAS Name: 2-[[3-(cyclohexylamino)-3-oxopropyl]thio]propanoic acid IUPAC Name: 2-[3-(cyclohexylamino)-3-oxopropyl]sulfanylpropanoic acid Traditional Name: 2-[[3-(cyclohexylamino)-3-keto-propyl]thio]propionic acid Formula: C12H21NO3S MolecularWeight: 259.36504

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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