heptyl (2S)-2-(methoxycarbonylamino)-4-methylsulfanyl-butanoate

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

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCOC(=O)C(CCSC)NC(=O)OC

Isomeric SMILES

CCCCCCCOC(=O)[C@H](CCSC)NC(=O)OC

InChI

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