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pyren-1-ylmethyl 3,5-bis(oxidanyl)benzoate

pyren-1-ylmethyl 3,5-bis(oxidanyl)benzoate

Systemtic Name:pyren-1-ylmethyl 3,5-bis(oxidanyl)benzoate
Openeye Name:pyren-1-ylmethyl 3,5-dihydroxybenzoate
CAS Name:3,5-dihydroxybenzoic acid 1-pyrenylmethyl ester
IUPAC Name:pyren-1-ylmethyl 3,5-dihydroxybenzoate
Traditional Name:3,5-dihydroxybenzoic acid pyren-1-ylmethyl ester
Formula: C24H16O4
MolecularWeight: 368.38144
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Descriptors Computed from Structure

Canonical SMILES:

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


Isomeric SMILES

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


InChI

InChI=1S/C24H16O4/c25-19-10-18(11-20(26)12-19)24(27)28-13-17-7-6-16-5-4-14-2-1-3-15-8-9-21(17)23(16)22(14)15/h1-12,25-26H,13H2


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