O3-[2-(4-cyanophenoxy)ethyl] O1-ethyl 5-nitrobenzene-1,3-dicarboxylate

Systemtic Name: O3-[2-(4-cyanophenoxy)ethyl] O1-ethyl 5-nitrobenzene-1,3-dicarboxylate Openeye Name: O3-[2-(4-cyanophenoxy)ethyl] O1-ethyl 5-nitrobenzene-1,3-dicarboxylate CAS Name: 5-nitrobenzene-1,3-dicarboxylic acid O3-[2-(4-cyanophenoxy)ethyl] ester O1-ethyl ester IUPAC Name: 3-O-[2-(4-cyanophenoxy)ethyl] 1-O-ethyl 5-nitrobenzene-1,3-dicarboxylate Traditional Name: 5-nitrobenzene-1,3-dicarboxylic acid O3-[2-(4-cyanophenoxy)ethyl] ester O1-ethyl ester Formula: C19H16N2O7 MolecularWeight: 384.33954

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC(=CC(=C1)[N+](=O)[O-])C(=O)OCCOC2=CC=C(C=C2)C#N

Isomeric SMILES

CCOC(=O)C1=CC(=CC(=C1)[N+](=O)[O-])C(=O)OCCOC2=CC=C(C=C2)C#N

InChI

InChI=1S/C19H16N2O7/c1-2-26-18(22)14-9-15(11-16(10-14)21(24)25)19(23)28-8-7-27-17-5-3-13(12-20)4-6-17/h3-6,9-11H,2,7-8H2,1H3