O4-[[5-[[4-[2,3-di(tetradecanoyloxy)propoxy]-4-oxidanylidene-butanoyl]oxymethyl]-2-ethyl-2-methyl-1,3-dioxolan-4-yl]methyl] O1-[2-[(phenylmethyl)disulfanyl]ethyl] butanedioate

Systemtic Name: O4-[[5-[[4-[2,3-di(tetradecanoyloxy)propoxy]-4-oxidanylidene-butanoyl]oxymethyl]-2-ethyl-2-methyl-1,3-dioxolan-4-yl]methyl] O1-[2-[(phenylmethyl)disulfanyl]ethyl] butanedioate Openeye Name: O1-[2-(benzyldisulfanyl)ethyl] O4-[[5-[[4-[2,3-di(tetradecanoyloxy)propoxy]-4-oxo-butanoyl]oxymethyl]-2-ethyl-2-methyl-1,3-dioxolan-4-yl]methyl] butanedioate CAS Name: butanedioic acid O4-[[5-[[4-[2,3-bis(1-oxotetradecoxy)propoxy]-1,4-dioxobutoxy]methyl]-2-ethyl-2-methyl-1,3-dioxolan-4-yl]methyl] ester O1-[2-[(phenylmethyl)disulfanyl]ethyl] ester IUPAC Name: 1-O-[2-(benzyldisulfanyl)ethyl] 4-O-[[5-[[4-[2,3-di(tetradecanoyloxy)propoxy]-4-oxobutanoyl]oxymethyl]-2-ethyl-2-methyl-1,3-dioxolan-4-yl]methyl] butanedioate Traditional Name: succinic acid O1-[2-(benzyldisulfanyl)ethyl] ester O4-[[5-[[4-[2,3-di(tetradecanoyloxy)propoxy]-4-keto-butanoyl]oxymethyl]-2-ethyl-2-methyl-1,3-dioxolan-4-yl]methyl] ester Formula: C56H92O14S2 MolecularWeight: 1053.45128

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCC(=O)OCC(COC(=O)CCC(=O)OCC1C(OC(O1)(C)CC)COC(=O)CCC(=O)OCCSSCC2=CC=CC=C2)OC(=O)CCCCCCCCCCCCC

Isomeric SMILES

CCCCCCCCCCCCCC(=O)OCC(COC(=O)CCC(=O)OCC1C(OC(O1)(C)CC)COC(=O)CCC(=O)OCCSSCC2=CC=CC=C2)OC(=O)CCCCCCCCCCCCC

InChI

InChI=1S/C56H92O14S2/c1-5-8-10-12-14-16-18-20-22-24-29-33-50(57)64-41-47(68-55(62)34-30-25-23-21-19-17-15-13-11-9-6-2)42-65-52(59)37-38-54(61)67-44-49-48(69-56(4,7-3)70-49)43-66-53(60)36-35-51(58)63-39-40-71-72-45-46-31-27-26-28-32-46/h26-28,31-32,47-49H,5-25,29-30,33-45H2,1-4H3