O1-methyl O3-(4-propanoylphenyl) 5-nitrobenzene-1,3-dicarboxylate

Systemtic Name: O1-methyl O3-(4-propanoylphenyl) 5-nitrobenzene-1,3-dicarboxylate Openeye Name: O1-methyl O3-(4-propanoylphenyl) 5-nitrobenzene-1,3-dicarboxylate CAS Name: 5-nitrobenzene-1,3-dicarboxylic acid O1-methyl ester O3-[4-(1-oxopropyl)phenyl] ester IUPAC Name: 1-O-methyl 3-O-(4-propanoylphenyl) 5-nitrobenzene-1,3-dicarboxylate Traditional Name: 5-nitrobenzene-1,3-dicarboxylic acid O1-methyl ester O3-(4-propionylphenyl) ester Formula: C18H15NO7 MolecularWeight: 357.3142

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H15NO7/c1-3-16(20)11-4-6-15(7-5-11)26-18(22)13-8-12(17(21)25-2)9-14(10-13)19(23)24/h4-10H,3H2,1-2H3