O3-(2-ethanoyl-4-methyl-phenyl) O1-methyl 5-nitrobenzene-1,3-dicarboxylate

Systemtic Name: O3-(2-ethanoyl-4-methyl-phenyl) O1-methyl 5-nitrobenzene-1,3-dicarboxylate Openeye Name: O3-(2-acetyl-4-methyl-phenyl) O1-methyl 5-nitrobenzene-1,3-dicarboxylate CAS Name: 5-nitrobenzene-1,3-dicarboxylic acid O3-(2-acetyl-4-methylphenyl) ester O1-methyl ester IUPAC Name: 3-O-(2-acetyl-4-methylphenyl) 1-O-methyl 5-nitrobenzene-1,3-dicarboxylate Traditional Name: 5-nitrobenzene-1,3-dicarboxylic acid O3-(2-acetyl-4-methyl-phenyl) ester O1-methyl ester Formula: C18H15NO7 MolecularWeight: 357.3142

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H15NO7/c1-10-4-5-16(15(6-10)11(2)20)26-18(22)13-7-12(17(21)25-3)8-14(9-13)19(23)24/h4-9H,1-3H3