phenylcarbonyl 3-cyanobenzenecarboperoxoate

Systemtic Name: phenylcarbonyl 3-cyanobenzenecarboperoxoate Openeye Name: benzoyl 3-cyanobenzenecarboperoxoate CAS Name: 3-cyanobenzenecarboperoxoic acid benzoyl ester IUPAC Name: benzoyl 3-cyanobenzenecarboperoxoate Traditional Name: 3-cyanobenzenecarboperoxoic acid benzoyl ester Formula: C15H9NO4 MolecularWeight: 267.23626

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C(=O)OOC(=O)C2=CC=CC(=C2)C#N

Isomeric SMILES

C1=CC=C(C=C1)C(=O)OOC(=O)C2=CC=CC(=C2)C#N

InChI

InChI=1S/C15H9NO4/c16-10-11-5-4-8-13(9-11)15(18)20-19-14(17)12-6-2-1-3-7-12/h1-9H