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

Systemtic Name: O3-[2-(4-cyanophenoxy)ethyl] O1-methyl 5-nitrobenzene-1,3-dicarboxylate Openeye Name: O3-[2-(4-cyanophenoxy)ethyl] O1-methyl 5-nitrobenzene-1,3-dicarboxylate CAS Name: 5-nitrobenzene-1,3-dicarboxylic acid O3-[2-(4-cyanophenoxy)ethyl] ester O1-methyl ester IUPAC Name: 3-O-[2-(4-cyanophenoxy)ethyl] 1-O-methyl 5-nitrobenzene-1,3-dicarboxylate Traditional Name: 5-nitrobenzene-1,3-dicarboxylic acid O3-[2-(4-cyanophenoxy)ethyl] ester O1-methyl ester Formula: C18H14N2O7 MolecularWeight: 370.31296

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H14N2O7/c1-25-17(21)13-8-14(10-15(9-13)20(23)24)18(22)27-7-6-26-16-4-2-12(11-19)3-5-16/h2-5,8-10H,6-7H2,1H3