O1-ethyl O3-[(3-methoxycarbonylphenyl)methyl] 5-nitrobenzene-1,3-dicarboxylate

Systemtic Name: O1-ethyl O3-[(3-methoxycarbonylphenyl)methyl] 5-nitrobenzene-1,3-dicarboxylate Openeye Name: O1-ethyl O3-[(3-methoxycarbonylphenyl)methyl] 5-nitrobenzene-1,3-dicarboxylate CAS Name: 5-nitrobenzene-1,3-dicarboxylic acid O1-ethyl ester O3-[(3-methoxycarbonylphenyl)methyl] ester IUPAC Name: 1-O-ethyl 3-O-[(3-methoxycarbonylphenyl)methyl] 5-nitrobenzene-1,3-dicarboxylate Traditional Name: 5-nitrobenzene-1,3-dicarboxylic acid O3-(3-carbomethoxybenzyl) ester O1-ethyl ester Formula: C19H17NO8 MolecularWeight: 387.34018

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC(=CC(=C1)C(=O)OCC2=CC=CC(=C2)C(=O)OC)[N+](=O)[O-]

Isomeric SMILES

CCOC(=O)C1=CC(=CC(=C1)C(=O)OCC2=CC=CC(=C2)C(=O)OC)[N+](=O)[O-]

InChI

InChI=1S/C19H17NO8/c1-3-27-18(22)14-8-15(10-16(9-14)20(24)25)19(23)28-11-12-5-4-6-13(7-12)17(21)26-2/h4-10H,3,11H2,1-2H3