3-ethylsulfanyl-2-formamido-3-methyl-octanoic acid

Systemtic Name: 3-ethylsulfanyl-2-formamido-3-methyl-octanoic acid Openeye Name: 3-ethylsulfanyl-2-formamido-3-methyl-octanoic acid CAS Name: 3-(ethylthio)-2-formamido-3-methyloctanoic acid IUPAC Name: 3-ethylsulfanyl-2-formamido-3-methyloctanoic acid Traditional Name: 3-(ethylthio)-2-formamido-3-methyl-caprylic acid Formula: C12H23NO3S MolecularWeight: 261.38092

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC(C)(C(C(=O)O)NC=O)SCC

Isomeric SMILES

CCCCCC(C)(C(C(=O)O)NC=O)SCC

InChI

InChI=1S/C12H23NO3S/c1-4-6-7-8-12(3,17-5-2)10(11(15)16)13-9-14/h9-10H,4-8H2,1-3H3,(H,13,14)(H,15,16)