O4-[(1,3-diphenylpyrazol-4-yl)methyl] O1-ethyl (E)-but-2-enedioate

Systemtic Name: O4-[(1,3-diphenylpyrazol-4-yl)methyl] O1-ethyl (E)-but-2-enedioate Openeye Name: O4-[(1,3-diphenylpyrazol-4-yl)methyl] O1-ethyl (E)-but-2-enedioate CAS Name: (E)-2-butenedioic acid O4-[(1,3-diphenyl-4-pyrazolyl)methyl] ester O1-ethyl ester IUPAC Name: 4-O-[(1,3-diphenylpyrazol-4-yl)methyl] 1-O-ethyl (E)-but-2-enedioate Traditional Name: (E)-but-2-enedioic acid O4-[(1,3-diphenylpyrazol-4-yl)methyl] ester O1-ethyl ester Formula: C22H20N2O4 MolecularWeight: 376.4052

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C=CC(=O)OCC1=CN(N=C1C2=CC=CC=C2)C3=CC=CC=C3

Isomeric SMILES

CCOC(=O)/C=C/C(=O)OCC1=CN(N=C1C2=CC=CC=C2)C3=CC=CC=C3

InChI

InChI=1S/C22H20N2O4/c1-2-27-20(25)13-14-21(26)28-16-18-15-24(19-11-7-4-8-12-19)23-22(18)17-9-5-3-6-10-17/h3-15H,2,16H2,1H3/b14-13+