2-pyren-1-ylcarbonylbenzoate

Systemtic Name: 2-pyren-1-ylcarbonylbenzoate Openeye Name: 2-(pyrene-1-carbonyl)benzoate CAS Name: 2-[oxo(1-pyrenyl)methyl]benzoate IUPAC Name: 2-(pyrene-1-carbonyl)benzoate Traditional Name: 2-(pyrene-1-carbonyl)benzoate Formula: C24H13O3- MolecularWeight: 349.35822

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C(=C1)C(=O)C2=C3C=CC4=CC=CC5=C4C3=C(C=C5)C=C2)C(=O)[O-]

Isomeric SMILES

C1=CC=C(C(=C1)C(=O)C2=C3C=CC4=CC=CC5=C4C3=C(C=C5)C=C2)C(=O)[O-]

InChI

InChI=1S/C24H14O3/c25-23(18-6-1-2-7-20(18)24(26)27)19-13-11-16-9-8-14-4-3-5-15-10-12-17(19)22(16)21(14)15/h1-13H,(H,26,27)/p-1