heptyl 2-azanyl-4-methylsulfanyl-butanoate

Systemtic Name: heptyl 2-azanyl-4-methylsulfanyl-butanoate Openeye Name: heptyl 2-amino-4-methylsulfanyl-butanoate CAS Name: 2-amino-4-(methylthio)butanoic acid heptyl ester IUPAC Name: heptyl 2-amino-4-methylsulfanylbutanoate Traditional Name: 2-amino-4-(methylthio)butyric acid heptyl ester Formula: C12H25NO2S MolecularWeight: 247.3974

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCOC(=O)C(CCSC)N

Isomeric SMILES

CCCCCCCOC(=O)C(CCSC)N

InChI

InChI=1S/C12H25NO2S/c1-3-4-5-6-7-9-15-12(14)11(13)8-10-16-2/h11H,3-10,13H2,1-2H3