(4-ethenylphenyl)carbonyl 3-(1-adamantyl)benzenecarboperoxoate

Systemtic Name: (4-ethenylphenyl)carbonyl 3-(1-adamantyl)benzenecarboperoxoate Openeye Name: (4-vinylbenzoyl) 3-(1-adamantyl)benzenecarboperoxoate CAS Name: 3-(1-adamantyl)benzenecarboperoxoic acid [(4-ethenylphenyl)-oxomethyl] ester IUPAC Name: (4-ethenylbenzoyl) 3-(1-adamantyl)benzenecarboperoxoate Traditional Name: 3-(1-adamantyl)benzenecarboperoxoic acid (4-vinylbenzoyl) ester Formula: C26H26O4 MolecularWeight: 402.48224

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C=CC1=CC=C(C=C1)C(=O)OOC(=O)C2=CC(=CC=C2)C34CC5CC(C3)CC(C5)C4

Isomeric SMILES

C=CC1=CC=C(C=C1)C(=O)OOC(=O)C2=CC(=CC=C2)C34CC5CC(C3)CC(C5)C4

InChI

InChI=1S/C26H26O4/c1-2-17-6-8-21(9-7-17)24(27)29-30-25(28)22-4-3-5-23(13-22)26-14-18-10-19(15-26)12-20(11-18)16-26/h2-9,13,18-20H,1,10-12,14-16H2