2-azanyl-3-hexylsulfanyl-3-methyl-nonanoic acid

Systemtic Name: 2-azanyl-3-hexylsulfanyl-3-methyl-nonanoic acid Openeye Name: 2-amino-3-hexylsulfanyl-3-methyl-nonanoic acid CAS Name: 2-amino-3-(hexylthio)-3-methylnonanoic acid IUPAC Name: 2-amino-3-hexylsulfanyl-3-methylnonanoic acid Traditional Name: 2-amino-3-(hexylthio)-3-methyl-pelargonic acid Formula: C16H33NO2S MolecularWeight: 303.50372

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCC(C)(C(C(=O)O)N)SCCCCCC

Isomeric SMILES

CCCCCCC(C)(C(C(=O)O)N)SCCCCCC

InChI

InChI=1S/C16H33NO2S/c1-4-6-8-10-12-16(3,14(17)15(18)19)20-13-11-9-7-5-2/h14H,4-13,17H2,1-3H3,(H,18,19)