3-(1-adamantyl)-4-methoxy-benzenecarboperoxoic acid

Systemtic Name: 3-(1-adamantyl)-4-methoxy-benzenecarboperoxoic acid Openeye Name: 3-(1-adamantyl)-4-methoxy-benzenecarboperoxoic acid CAS Name: 3-(1-adamantyl)-4-methoxybenzenecarboperoxoic acid IUPAC Name: 3-(1-adamantyl)-4-methoxybenzenecarboperoxoic acid Traditional Name: 3-(1-adamantyl)-4-methoxy-perbenzoic acid Formula: C18H22O4 MolecularWeight: 302.36488

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C(=O)OO)C23CC4CC(C2)CC(C4)C3

Isomeric SMILES

COC1=C(C=C(C=C1)C(=O)OO)C23CC4CC(C2)CC(C4)C3

InChI

InChI=1S/C18H22O4/c1-21-16-3-2-14(17(19)22-20)7-15(16)18-8-11-4-12(9-18)6-13(5-11)10-18/h2-3,7,11-13,20H,4-6,8-10H2,1H3