O4-[2-[[4-(cyanomethyl)phenyl]amino]-2-oxidanylidene-ethyl] O1-methyl benzene-1,4-dicarboxylate

Systemtic Name: O4-[2-[[4-(cyanomethyl)phenyl]amino]-2-oxidanylidene-ethyl] O1-methyl benzene-1,4-dicarboxylate Openeye Name: O4-[2-[4-(cyanomethyl)anilino]-2-oxo-ethyl] O1-methyl benzene-1,4-dicarboxylate CAS Name: benzene-1,4-dicarboxylic acid O4-[2-[4-(cyanomethyl)anilino]-2-oxoethyl] ester O1-methyl ester IUPAC Name: 4-O-[2-[4-(cyanomethyl)anilino]-2-oxoethyl] 1-O-methyl benzene-1,4-dicarboxylate Traditional Name: benzene-1,4-dicarboxylic acid O4-[2-[4-(cyanomethyl)anilino]-2-keto-ethyl] ester O1-methyl ester Formula: C19H16N2O5 MolecularWeight: 352.34074

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC=C(C=C1)C(=O)OCC(=O)NC2=CC=C(C=C2)CC#N

Isomeric SMILES

COC(=O)C1=CC=C(C=C1)C(=O)OCC(=O)NC2=CC=C(C=C2)CC#N

InChI

InChI=1S/C19H16N2O5/c1-25-18(23)14-4-6-15(7-5-14)19(24)26-12-17(22)21-16-8-2-13(3-9-16)10-11-20/h2-9H,10,12H2,1H3,(H,21,22)