O4-[(1,3-diphenylpyrazol-4-yl)methyl] O1-methyl benzene-1,4-dicarboxylate

Systemtic Name: O4-[(1,3-diphenylpyrazol-4-yl)methyl] O1-methyl benzene-1,4-dicarboxylate Openeye Name: O4-[(1,3-diphenylpyrazol-4-yl)methyl] O1-methyl benzene-1,4-dicarboxylate CAS Name: benzene-1,4-dicarboxylic acid O4-[(1,3-diphenyl-4-pyrazolyl)methyl] ester O1-methyl ester IUPAC Name: 4-O-[(1,3-diphenylpyrazol-4-yl)methyl] 1-O-methyl benzene-1,4-dicarboxylate Traditional Name: benzene-1,4-dicarboxylic acid O4-[(1,3-diphenylpyrazol-4-yl)methyl] ester O1-methyl ester Formula: C25H20N2O4 MolecularWeight: 412.4373

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC=C(C=C1)C(=O)OCC2=CN(N=C2C3=CC=CC=C3)C4=CC=CC=C4

Isomeric SMILES

COC(=O)C1=CC=C(C=C1)C(=O)OCC2=CN(N=C2C3=CC=CC=C3)C4=CC=CC=C4

InChI

InChI=1S/C25H20N2O4/c1-30-24(28)19-12-14-20(15-13-19)25(29)31-17-21-16-27(22-10-6-3-7-11-22)26-23(21)18-8-4-2-5-9-18/h2-16H,17H2,1H3