3-heptyl-7-methyl-7-oct-1-en-2-ylperoxy-isochromene-6,8-dione

Systemtic Name: 3-heptyl-7-methyl-7-oct-1-en-2-ylperoxy-isochromene-6,8-dione Openeye Name: 3-heptyl-7-methyl-7-(1-methyleneheptylperoxy)isochromene-6,8-dione CAS Name: 3-heptyl-7-methyl-7-oct-1-en-2-yldioxy-2-benzopyran-6,8-dione IUPAC Name: 3-heptyl-7-methyl-7-oct-1-en-2-ylperoxyisochromene-6,8-dione Traditional Name: 3-heptyl-7-(1-hexylvinylperoxy)-7-methyl-isochromene-6,8-quinone Formula: C25H36O5 MolecularWeight: 416.55034

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCC1=CC2=CC(=O)C(C(=O)C2=CO1)(C)OOC(=C)CCCCCC

Isomeric SMILES

CCCCCCCC1=CC2=CC(=O)C(C(=O)C2=CO1)(C)OOC(=C)CCCCCC

InChI

InChI=1S/C25H36O5/c1-5-7-9-11-13-15-21-16-20-17-23(26)25(4,24(27)22(20)18-28-21)30-29-19(3)14-12-10-8-6-2/h16-18H,3,5-15H2,1-2,4H3