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

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

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1N2C(=CC(=N2)C(C)C)OC(=O)C=CC3=CC=CC=C3

Isomeric SMILES

CC1=CC=CC=C1N2C(=CC(=N2)C(C)C)OC(=O)/C=C/C3=CC=CC=C3

InChI

InChI=1S/C22H22N2O2/c1-16(2)19-15-21(24(23-19)20-12-8-7-9-17(20)3)26-22(25)14-13-18-10-5-4-6-11-18/h4-16H,1-3H3/b14-13+