sodium [phenoxy-[4-(phenylcarbonyl)phenoxy]phosphoryl] ethaneperoxoate

Systemtic Name: sodium [phenoxy-[4-(phenylcarbonyl)phenoxy]phosphoryl] ethaneperoxoate Openeye Name: sodium [(4-benzoylphenoxy)-phenoxy-phosphoryl] peroxyacetate CAS Name: sodium ethaneperoxoic acid [(4-benzoylphenoxy)-phenoxyphosphoryl] ester IUPAC Name: sodium [(4-benzoylphenoxy)-phenoxyphosphoryl] ethaneperoxoate Traditional Name: sodium peracetic acid [(4-benzoylphenoxy)-phenoxy-phosphoryl] ester Formula: C21H17NaO7P+ MolecularWeight: 435.319011

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)OOP(=O)(OC1=CC=CC=C1)OC2=CC=C(C=C2)C(=O)C3=CC=CC=C3.[Na+]

Isomeric SMILES

CC(=O)OOP(=O)(OC1=CC=CC=C1)OC2=CC=C(C=C2)C(=O)C3=CC=CC=C3.[Na+]

InChI

InChI=1S/C21H17O7P.Na/c1-16(22)25-28-29(24,26-19-10-6-3-7-11-19)27-20-14-12-18(13-15-20)21(23)17-8-4-2-5-9-17;/h2-15H,1H3;/q;+1