hexyl (2S)-2-(ethoxycarbonylamino)-4-methylsulfanyl-butanoate

Systemtic Name: hexyl (2S)-2-(ethoxycarbonylamino)-4-methylsulfanyl-butanoate Openeye Name: hexyl (2S)-2-(ethoxycarbonylamino)-4-methylsulfanyl-butanoate CAS Name: (2S)-2-(ethoxycarbonylamino)-4-(methylthio)butanoic acid hexyl ester IUPAC Name: hexyl (2S)-2-(ethoxycarbonylamino)-4-methylsulfanylbutanoate Traditional Name: (2S)-2-(carbethoxyamino)-4-(methylthio)butyric acid hexyl ester Formula: C14H27NO4S MolecularWeight: 305.43348

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCOC(=O)C(CCSC)NC(=O)OCC

Isomeric SMILES

CCCCCCOC(=O)[C@H](CCSC)NC(=O)OCC

InChI

InChI=1S/C14H27NO4S/c1-4-6-7-8-10-19-13(16)12(9-11-20-3)15-14(17)18-5-2/h12H,4-11H2,1-3H3,(H,15,17)/t12-/m0/s1