2,2-bis(phenylcarbonylperoxycarbonyloxymethyl)butoxycarbonyl 4-methylbenzenecarboperoxoate

Systemtic Name: 2,2-bis(phenylcarbonylperoxycarbonyloxymethyl)butoxycarbonyl 4-methylbenzenecarboperoxoate Openeye Name: 2,2-bis(benzoylperoxycarbonyloxymethyl)butoxycarbonyl 4-methylbenzenecarboperoxoate CAS Name: 4-methylbenzenecarboperoxoic acid [2,2-bis[[benzoyldioxy(oxo)methoxy]methyl]butoxy-oxomethyl] ester IUPAC Name: 2,2-bis(benzoylperoxycarbonyloxymethyl)butoxycarbonyl 4-methylbenzenecarboperoxoate Traditional Name: 4-methylbenzenecarboperoxoic acid 2,2-bis(benzoylperoxycarbonyloxymethyl)butoxycarbonyl ester Formula: C31H28O15 MolecularWeight: 640.54502

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Descriptors Computed from Structure

Canonical SMILES:

CCC(COC(=O)OOC(=O)C1=CC=CC=C1)(COC(=O)OOC(=O)C2=CC=CC=C2)COC(=O)OOC(=O)C3=CC=C(C=C3)C

Isomeric SMILES

CCC(COC(=O)OOC(=O)C1=CC=CC=C1)(COC(=O)OOC(=O)C2=CC=CC=C2)COC(=O)OOC(=O)C3=CC=C(C=C3)C

InChI

InChI=1S/C31H28O15/c1-3-31(18-38-28(35)44-41-25(32)22-10-6-4-7-11-22,19-39-29(36)45-42-26(33)23-12-8-5-9-13-23)20-40-30(37)46-43-27(34)24-16-14-21(2)15-17-24/h4-17H,3,18-20H2,1-2H3