[4-(3-hexylsulfanylpropanoyloxy)-2-methyl-pentan-2-yl] 3-ethyl-4-propyl-1,2-dioxetane-3-carboxylate

Systemtic Name: [4-(3-hexylsulfanylpropanoyloxy)-2-methyl-pentan-2-yl] 3-ethyl-4-propyl-1,2-dioxetane-3-carboxylate Openeye Name: [3-(3-hexylsulfanylpropanoyloxy)-1,1-dimethyl-butyl] 3-ethyl-4-propyl-dioxetane-3-carboxylate CAS Name: 3-ethyl-4-propyl-3-dioxetanecarboxylic acid [4-[3-(hexylthio)-1-oxopropoxy]-2-methylpentan-2-yl] ester IUPAC Name: [4-(3-hexylsulfanylpropanoyloxy)-2-methylpentan-2-yl] 3-ethyl-4-propyldioxetane-3-carboxylate Traditional Name: 3-ethyl-4-propyl-dioxetane-3-carboxylic acid [3-[3-(hexylthio)propanoyloxy]-1,1-dimethyl-butyl] ester Formula: C23H42O6S MolecularWeight: 446.64098

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCCSCCC(=O)OC(C)CC(C)(C)OC(=O)C1(C(OO1)CCC)CC

Isomeric SMILES

CCCCCCSCCC(=O)OC(C)CC(C)(C)OC(=O)C1(C(OO1)CCC)CC

InChI

InChI=1S/C23H42O6S/c1-7-10-11-12-15-30-16-14-20(24)26-18(4)17-22(5,6)27-21(25)23(9-3)19(13-8-2)28-29-23/h18-19H,7-17H2,1-6H3