methyl 2-pyren-1-yloxycarbonyloxybenzoate

Systemtic Name: methyl 2-pyren-1-yloxycarbonyloxybenzoate Openeye Name: methyl 2-pyren-1-yloxycarbonyloxybenzoate CAS Name: 2-[oxo(1-pyrenyloxy)methoxy]benzoic acid methyl ester IUPAC Name: methyl 2-pyren-1-yloxycarbonyloxybenzoate Traditional Name: 2-pyren-1-yloxycarbonyloxybenzoic acid methyl ester Formula: C25H16O5 MolecularWeight: 396.39154

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC=CC=C1OC(=O)OC2=C3C=CC4=CC=CC5=C4C3=C(C=C5)C=C2

Isomeric SMILES

COC(=O)C1=CC=CC=C1OC(=O)OC2=C3C=CC4=CC=CC5=C4C3=C(C=C5)C=C2

InChI

InChI=1S/C25H16O5/c1-28-24(26)19-7-2-3-8-20(19)29-25(27)30-21-14-12-17-10-9-15-5-4-6-16-11-13-18(21)23(17)22(15)16/h2-14H,1H3