4-methylpentyl 2-(methoxycarbonylamino)-4-methylsulfanyl-butanoate

Systemtic Name: 4-methylpentyl 2-(methoxycarbonylamino)-4-methylsulfanyl-butanoate Openeye Name: isohexyl 2-(methoxycarbonylamino)-4-methylsulfanyl-butanoate CAS Name: 2-(methoxycarbonylamino)-4-(methylthio)butanoic acid 4-methylpentyl ester IUPAC Name: 4-methylpentyl 2-(methoxycarbonylamino)-4-methylsulfanylbutanoate Traditional Name: 2-(carbomethoxyamino)-4-(methylthio)butyric acid isohexyl ester Formula: C13H25NO4S MolecularWeight: 291.4069

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CCCOC(=O)C(CCSC)NC(=O)OC

Isomeric SMILES

CC(C)CCCOC(=O)C(CCSC)NC(=O)OC

InChI

InChI=1S/C13H25NO4S/c1-10(2)6-5-8-18-12(15)11(7-9-19-4)14-13(16)17-3/h10-11H,5-9H2,1-4H3,(H,14,16)