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

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

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)NC(=O)CCSCCC(=O)O

Isomeric SMILES

C1CCC(CC1)NC(=O)CCSCCC(=O)O

InChI

InChI=1S/C12H21NO3S/c14-11(6-8-17-9-7-12(15)16)13-10-4-2-1-3-5-10/h10H,1-9H2,(H,13,14)(H,15,16)