(3-methanoyl-4-nitro-phenyl) 2-[(4-methyl-3-oxidanyl-phenyl)peroxymethyl]benzoate

Systemtic Name: (3-methanoyl-4-nitro-phenyl) 2-[(4-methyl-3-oxidanyl-phenyl)peroxymethyl]benzoate Openeye Name: (3-formyl-4-nitro-phenyl) 2-[(3-hydroxy-4-methyl-phenyl)peroxymethyl]benzoate CAS Name: 2-[(3-hydroxy-4-methylphenyl)dioxymethyl]benzoic acid (3-formyl-4-nitrophenyl) ester IUPAC Name: (3-formyl-4-nitrophenyl) 2-[(3-hydroxy-4-methylphenyl)peroxymethyl]benzoate Traditional Name: 2-[(3-hydroxy-4-methyl-phenyl)peroxymethyl]benzoic acid (3-formyl-4-nitro-phenyl) ester Formula: C22H17NO8 MolecularWeight: 423.37228

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)OOCC2=CC=CC=C2C(=O)OC3=CC(=C(C=C3)[N+](=O)[O-])C=O)O

Isomeric SMILES

CC1=C(C=C(C=C1)OOCC2=CC=CC=C2C(=O)OC3=CC(=C(C=C3)[N+](=O)[O-])C=O)O

InChI

InChI=1S/C22H17NO8/c1-14-6-7-18(11-21(14)25)31-29-13-15-4-2-3-5-19(15)22(26)30-17-8-9-20(23(27)28)16(10-17)12-24/h2-12,25H,13H2,1H3