[3-(1-adamantyl)phenyl]carbonyl 2,4-dimethoxybenzenecarboperoxoate

Systemtic Name: [3-(1-adamantyl)phenyl]carbonyl 2,4-dimethoxybenzenecarboperoxoate Openeye Name: [3-(1-adamantyl)benzoyl] 2,4-dimethoxybenzenecarboperoxoate CAS Name: 2,4-dimethoxybenzenecarboperoxoic acid [[3-(1-adamantyl)phenyl]-oxomethyl] ester IUPAC Name: [3-(1-adamantyl)benzoyl] 2,4-dimethoxybenzenecarboperoxoate Traditional Name: 2,4-dimethoxybenzenecarboperoxoic acid [3-(1-adamantyl)benzoyl] ester Formula: C26H28O6 MolecularWeight: 436.49692

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C=C1)C(=O)OOC(=O)C2=CC(=CC=C2)C34CC5CC(C3)CC(C5)C4)OC

Isomeric SMILES

COC1=CC(=C(C=C1)C(=O)OOC(=O)C2=CC(=CC=C2)C34CC5CC(C3)CC(C5)C4)OC

InChI

InChI=1S/C26H28O6/c1-29-21-6-7-22(23(12-21)30-2)25(28)32-31-24(27)19-4-3-5-20(11-19)26-13-16-8-17(14-26)10-18(9-16)15-26/h3-7,11-12,16-18H,8-10,13-15H2,1-2H3