[6-(4-ethylphenyl)carbonylperoxycarbonyloxy-3,4-bis[(4-ethylphenyl)carbonylperoxycarbonyloxymethyl]hexoxy]carbonyl 4-ethylbenzenecarboperoxoate

Systemtic Name: [6-(4-ethylphenyl)carbonylperoxycarbonyloxy-3,4-bis[(4-ethylphenyl)carbonylperoxycarbonyloxymethyl]hexoxy]carbonyl 4-ethylbenzenecarboperoxoate Openeye Name: [6-(4-ethylbenzoyl)peroxycarbonyloxy-3,4-bis[(4-ethylbenzoyl)peroxycarbonyloxymethyl]hexoxy]carbonyl 4-ethylbenzenecarboperoxoate CAS Name: 4-ethylbenzenecarboperoxoic acid [[6-[[(4-ethylphenyl)-oxomethyl]dioxy-oxomethoxy]-3,4-bis[[[(4-ethylphenyl)-oxomethyl]dioxy-oxomethoxy]methyl]hexoxy]-oxomethyl] ester IUPAC Name: [6-(4-ethylbenzoyl)peroxycarbonyloxy-3,4-bis[(4-ethylbenzoyl)peroxycarbonyloxymethyl]hexoxy]carbonyl 4-ethylbenzenecarboperoxoate Traditional Name: 4-ethylbenzenecarboperoxoic acid [6-(4-ethylbenzoyl)peroxycarbonyloxy-3,4-bis[(4-ethylbenzoyl)peroxycarbonyloxymethyl]hexoxy]carbonyl ester Formula: C48H50O20 MolecularWeight: 946.8986

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(C=C1)C(=O)OOC(=O)OCCC(COC(=O)OOC(=O)C2=CC=C(C=C2)CC)C(CCOC(=O)OOC(=O)C3=CC=C(C=C3)CC)COC(=O)OOC(=O)C4=CC=C(C=C4)CC

Isomeric SMILES

CCC1=CC=C(C=C1)C(=O)OOC(=O)OCCC(COC(=O)OOC(=O)C2=CC=C(C=C2)CC)C(CCOC(=O)OOC(=O)C3=CC=C(C=C3)CC)COC(=O)OOC(=O)C4=CC=C(C=C4)CC

InChI

InChI=1S/C48H50O20/c1-5-31-9-17-35(18-10-31)41(49)61-65-45(53)57-27-25-39(29-59-47(55)67-63-43(51)37-21-13-33(7-3)14-22-37)40(30-60-48(56)68-64-44(52)38-23-15-34(8-4)16-24-38)26-28-58-46(54)66-62-42(50)36-19-11-32(6-2)12-20-36/h9-24,39-40H,5-8,25-30H2,1-4H3