O1-[2-(hydroxymethyl)-4-nitro-phenyl] O2-(2-methanoyl-4-methyl-phenyl) ethanedioate

Systemtic Name: O1-[2-(hydroxymethyl)-4-nitro-phenyl] O2-(2-methanoyl-4-methyl-phenyl) ethanedioate Openeye Name: O2-(2-formyl-4-methyl-phenyl) O1-[2-(hydroxymethyl)-4-nitro-phenyl] oxalate CAS Name: oxalic acid O2-(2-formyl-4-methylphenyl) ester O1-[2-(hydroxymethyl)-4-nitrophenyl] ester IUPAC Name: 2-O-(2-formyl-4-methylphenyl) 1-O-[2-(hydroxymethyl)-4-nitrophenyl] oxalate Traditional Name: oxalic acid O2-(2-formyl-4-methyl-phenyl) ester O1-(2-methylol-4-nitro-phenyl) ester Formula: C17H13NO8 MolecularWeight: 359.28702

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)OC(=O)C(=O)OC2=C(C=C(C=C2)[N+](=O)[O-])CO)C=O

Isomeric SMILES

CC1=CC(=C(C=C1)OC(=O)C(=O)OC2=C(C=C(C=C2)[N+](=O)[O-])CO)C=O

InChI

InChI=1S/C17H13NO8/c1-10-2-4-14(11(6-10)8-19)25-16(21)17(22)26-15-5-3-13(18(23)24)7-12(15)9-20/h2-8,20H,9H2,1H3