2,2-bis(2-undec-10-enoylsulfanylethanoyloxymethyl)butyl 2-undec-10-enoylsulfanylethanoate

Systemtic Name: 2,2-bis(2-undec-10-enoylsulfanylethanoyloxymethyl)butyl 2-undec-10-enoylsulfanylethanoate Openeye Name: 2,2-bis[(2-undec-10-enoylsulfanylacetyl)oxymethyl]butyl 2-undec-10-enoylsulfanylacetate CAS Name: 2-(1-oxoundec-10-enylthio)acetic acid 2,2-bis[[1-oxo-2-(1-oxoundec-10-enylthio)ethoxy]methyl]butyl ester IUPAC Name: 2,2-bis[(2-undec-10-enoylsulfanylacetyl)oxymethyl]butyl 2-undec-10-enoylsulfanylacetate Traditional Name: 2-(undec-10-enoylthio)acetic acid 2,2-bis[[2-(undec-10-enoylthio)acetyl]oxymethyl]butyl ester Formula: C45H74O9S3 MolecularWeight: 855.25866

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Descriptors Computed from Structure

Canonical SMILES:

CCC(COC(=O)CSC(=O)CCCCCCCCC=C)(COC(=O)CSC(=O)CCCCCCCCC=C)COC(=O)CSC(=O)CCCCCCCCC=C

Isomeric SMILES

CCC(COC(=O)CSC(=O)CCCCCCCCC=C)(COC(=O)CSC(=O)CCCCCCCCC=C)COC(=O)CSC(=O)CCCCCCCCC=C

InChI

InChI=1S/C45H74O9S3/c1-5-9-12-15-18-21-24-27-30-42(49)55-33-39(46)52-36-45(8-4,37-53-40(47)34-56-43(50)31-28-25-22-19-16-13-10-6-2)38-54-41(48)35-57-44(51)32-29-26-23-20-17-14-11-7-3/h5-7H,1-3,8-38H2,4H3