(3-methoxyphenyl)carbonyl 3-(1-adamantyl)-4-methoxy-benzenecarboperoxoate

Systemtic Name: (3-methoxyphenyl)carbonyl 3-(1-adamantyl)-4-methoxy-benzenecarboperoxoate Openeye Name: (3-methoxybenzoyl) 3-(1-adamantyl)-4-methoxy-benzenecarboperoxoate CAS Name: 3-(1-adamantyl)-4-methoxybenzenecarboperoxoic acid [(3-methoxyphenyl)-oxomethyl] ester IUPAC Name: (3-methoxybenzoyl) 3-(1-adamantyl)-4-methoxybenzenecarboperoxoate Traditional Name: 3-(1-adamantyl)-4-methoxy-benzenecarboperoxoic acid m-anisoyl ester Formula: C26H28O6 MolecularWeight: 436.49692

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C26H28O6/c1-29-21-5-3-4-19(11-21)24(27)31-32-25(28)20-6-7-23(30-2)22(12-20)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