bis[(4-pyrazol-1-ylphenyl)methyl] (E)-but-2-enedioate

Systemtic Name: bis[(4-pyrazol-1-ylphenyl)methyl] (E)-but-2-enedioate Openeye Name: bis[(4-pyrazol-1-ylphenyl)methyl] (E)-but-2-enedioate CAS Name: (E)-2-butenedioic acid bis[[4-(1-pyrazolyl)phenyl]methyl] ester IUPAC Name: bis[(4-pyrazol-1-ylphenyl)methyl] (E)-but-2-enedioate Traditional Name: (E)-but-2-enedioic acid bis(4-pyrazol-1-ylbenzyl) ester Formula: C24H20N4O4 MolecularWeight: 428.44

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Descriptors Computed from Structure

Canonical SMILES:

C1=CN(N=C1)C2=CC=C(C=C2)COC(=O)C=CC(=O)OCC3=CC=C(C=C3)N4C=CC=N4

Isomeric SMILES

C1=CN(N=C1)C2=CC=C(C=C2)COC(=O)/C=C/C(=O)OCC3=CC=C(C=C3)N4C=CC=N4

InChI

InChI=1S/C24H20N4O4/c29-23(31-17-19-3-7-21(8-4-19)27-15-1-13-25-27)11-12-24(30)32-18-20-5-9-22(10-6-20)28-16-2-14-26-28/h1-16H,17-18H2/b12-11+