4-methylpentyl 4-methylsulfanyl-2-(prop-2-enoxycarbonylamino)butanoate

Systemtic Name: 4-methylpentyl 4-methylsulfanyl-2-(prop-2-enoxycarbonylamino)butanoate Openeye Name: isohexyl 2-(allyloxycarbonylamino)-4-methylsulfanyl-butanoate CAS Name: 4-(methylthio)-2-[[oxo(prop-2-enoxy)methyl]amino]butanoic acid 4-methylpentyl ester IUPAC Name: 4-methylpentyl 4-methylsulfanyl-2-(prop-2-enoxycarbonylamino)butanoate Traditional Name: 2-(allyloxycarbonylamino)-4-(methylthio)butyric acid isohexyl ester Formula: C15H27NO4S MolecularWeight: 317.44418

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C15H27NO4S/c1-5-9-20-15(18)16-13(8-11-21-4)14(17)19-10-6-7-12(2)3/h5,12-13H,1,6-11H2,2-4H3,(H,16,18)