[2-(4-methylphenyl)-5-propyl-pyrazol-3-yl] (E)-3-phenylprop-2-enoate

Systemtic Name: [2-(4-methylphenyl)-5-propyl-pyrazol-3-yl] (E)-3-phenylprop-2-enoate Openeye Name: [5-propyl-2-(p-tolyl)pyrazol-3-yl] (E)-3-phenylprop-2-enoate CAS Name: (E)-3-phenyl-2-propenoic acid [2-(4-methylphenyl)-5-propyl-3-pyrazolyl] ester IUPAC Name: [2-(4-methylphenyl)-5-propylpyrazol-3-yl] (E)-3-phenylprop-2-enoate Traditional Name: (E)-3-phenylacrylic acid [5-propyl-2-(p-tolyl)pyrazol-3-yl] ester Formula: C22H22N2O2 MolecularWeight: 346.42228

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=NN(C(=C1)OC(=O)C=CC2=CC=CC=C2)C3=CC=C(C=C3)C

Isomeric SMILES

CCCC1=NN(C(=C1)OC(=O)/C=C/C2=CC=CC=C2)C3=CC=C(C=C3)C

InChI

InChI=1S/C22H22N2O2/c1-3-7-19-16-21(24(23-19)20-13-10-17(2)11-14-20)26-22(25)15-12-18-8-5-4-6-9-18/h4-6,8-16H,3,7H2,1-2H3/b15-12+