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

Systemtic Name: 4-methylpentyl 2-(2-methylpropoxycarbonylamino)-4-methylsulfanyl-butanoate Openeye Name: isohexyl 2-(isobutoxycarbonylamino)-4-methylsulfanyl-butanoate CAS Name: 2-[[2-methylpropoxy(oxo)methyl]amino]-4-(methylthio)butanoic acid 4-methylpentyl ester IUPAC Name: 4-methylpentyl 2-(2-methylpropoxycarbonylamino)-4-methylsulfanylbutanoate Traditional Name: 2-(isobutoxycarbonylamino)-4-(methylthio)butyric acid isohexyl ester Formula: C16H31NO4S MolecularWeight: 333.48664

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H31NO4S/c1-12(2)7-6-9-20-15(18)14(8-10-22-5)17-16(19)21-11-13(3)4/h12-14H,6-11H2,1-5H3,(H,17,19)