[3-(4-hexylphenyl)carbonylperoxycarbonyloxy-2,2-bis[(4-hexylphenyl)carbonylperoxycarbonyloxymethyl]propoxy]carbonyl 4-hexylbenzenecarboperoxoate

Systemtic Name: [3-(4-hexylphenyl)carbonylperoxycarbonyloxy-2,2-bis[(4-hexylphenyl)carbonylperoxycarbonyloxymethyl]propoxy]carbonyl 4-hexylbenzenecarboperoxoate Openeye Name: [3-(4-hexylbenzoyl)peroxycarbonyloxy-2,2-bis[(4-hexylbenzoyl)peroxycarbonyloxymethyl]propoxy]carbonyl 4-hexylbenzenecarboperoxoate CAS Name: 4-hexylbenzenecarboperoxoic acid [[3-[[(4-hexylphenyl)-oxomethyl]dioxy-oxomethoxy]-2,2-bis[[[(4-hexylphenyl)-oxomethyl]dioxy-oxomethoxy]methyl]propoxy]-oxomethyl] ester IUPAC Name: [3-(4-hexylbenzoyl)peroxycarbonyloxy-2,2-bis[(4-hexylbenzoyl)peroxycarbonyloxymethyl]propoxy]carbonyl 4-hexylbenzenecarboperoxoate Traditional Name: 4-hexylbenzenecarboperoxoic acid [3-(4-hexylbenzoyl)peroxycarbonyloxy-2,2-bis[(4-hexylbenzoyl)peroxycarbonyloxymethyl]propoxy]carbonyl ester Formula: C61H76O20 MolecularWeight: 1129.24414

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCCC1=CC=C(C=C1)C(=O)OOC(=O)OCC(COC(=O)OOC(=O)C2=CC=C(C=C2)CCCCCC)(COC(=O)OOC(=O)C3=CC=C(C=C3)CCCCCC)COC(=O)OOC(=O)C4=CC=C(C=C4)CCCCCC

Isomeric SMILES

CCCCCCC1=CC=C(C=C1)C(=O)OOC(=O)OCC(COC(=O)OOC(=O)C2=CC=C(C=C2)CCCCCC)(COC(=O)OOC(=O)C3=CC=C(C=C3)CCCCCC)COC(=O)OOC(=O)C4=CC=C(C=C4)CCCCCC

InChI

InChI=1S/C61H76O20/c1-5-9-13-17-21-45-25-33-49(34-26-45)53(62)74-78-57(66)70-41-61(42-71-58(67)79-75-54(63)50-35-27-46(28-36-50)22-18-14-10-6-2,43-72-59(68)80-76-55(64)51-37-29-47(30-38-51)23-19-15-11-7-3)44-73-60(69)81-77-56(65)52-39-31-48(32-40-52)24-20-16-12-8-4/h25-40H,5-24,41-44H2,1-4H3