2-azanyl-3-ethylsulfanyl-3-methyl-octanoic acid

Systemtic Name: 2-azanyl-3-ethylsulfanyl-3-methyl-octanoic acid Openeye Name: 2-amino-3-ethylsulfanyl-3-methyl-octanoic acid CAS Name: 2-amino-3-(ethylthio)-3-methyloctanoic acid IUPAC Name: 2-amino-3-ethylsulfanyl-3-methyloctanoic acid Traditional Name: 2-amino-3-(ethylthio)-3-methyl-caprylic acid Formula: C11H23NO2S MolecularWeight: 233.37082

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC(C)(C(C(=O)O)N)SCC

Isomeric SMILES

CCCCCC(C)(C(C(=O)O)N)SCC

InChI

InChI=1S/C11H23NO2S/c1-4-6-7-8-11(3,15-5-2)9(12)10(13)14/h9H,4-8,12H2,1-3H3,(H,13,14)