4-(pyren-1-ylcarbonyloxymethylperoxy)benzoic acid

Systemtic Name: 4-(pyren-1-ylcarbonyloxymethylperoxy)benzoic acid Openeye Name: 4-(pyrene-1-carbonyloxymethylperoxy)benzoic acid CAS Name: 4-[[oxo(1-pyrenyl)methoxy]methyldioxy]benzoic acid IUPAC Name: 4-(pyrene-1-carbonyloxymethylperoxy)benzoic acid Traditional Name: 4-(pyrene-1-carbonyloxymethylperoxy)benzoic acid Formula: C25H16O6 MolecularWeight: 412.39094

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC2=C3C(=C1)C=CC4=C(C=CC(=C43)C=C2)C(=O)OCOOC5=CC=C(C=C5)C(=O)O

Isomeric SMILES

C1=CC2=C3C(=C1)C=CC4=C(C=CC(=C43)C=C2)C(=O)OCOOC5=CC=C(C=C5)C(=O)O

InChI

InChI=1S/C25H16O6/c26-24(27)18-6-10-19(11-7-18)31-30-14-29-25(28)21-13-9-17-5-4-15-2-1-3-16-8-12-20(21)23(17)22(15)16/h1-13H,14H2,(H,26,27)