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

Systemtic Name: (3-methanoyl-4-nitro-phenyl) 2-[[3-(hydroxymethyl)-4-methyl-phenyl]peroxymethyl]benzoate Openeye Name: (3-formyl-4-nitro-phenyl) 2-[[3-(hydroxymethyl)-4-methyl-phenyl]peroxymethyl]benzoate CAS Name: 2-[[3-(hydroxymethyl)-4-methylphenyl]dioxymethyl]benzoic acid (3-formyl-4-nitrophenyl) ester IUPAC Name: (3-formyl-4-nitrophenyl) 2-[[3-(hydroxymethyl)-4-methylphenyl]peroxymethyl]benzoate Traditional Name: 2-[(4-methyl-3-methylol-phenyl)peroxymethyl]benzoic acid (3-formyl-4-nitro-phenyl) ester Formula: C23H19NO8 MolecularWeight: 437.39886

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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)CO

Isomeric SMILES

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

InChI

InChI=1S/C23H19NO8/c1-15-6-7-20(10-17(15)12-25)32-30-14-16-4-2-3-5-21(16)23(27)31-19-8-9-22(24(28)29)18(11-19)13-26/h2-11,13,25H,12,14H2,1H3