[4-[(1,3,5-trimethylpyrazol-4-yl)methyl]phenyl] benzoate

Systemtic Name: [4-[(1,3,5-trimethylpyrazol-4-yl)methyl]phenyl] benzoate Openeye Name: [4-[(1,3,5-trimethylpyrazol-4-yl)methyl]phenyl] benzoate CAS Name: benzoic acid [4-[(1,3,5-trimethyl-4-pyrazolyl)methyl]phenyl] ester IUPAC Name: [4-[(1,3,5-trimethylpyrazol-4-yl)methyl]phenyl] benzoate Traditional Name: benzoic acid [4-[(1,3,5-trimethylpyrazol-4-yl)methyl]phenyl] ester Formula: C20H20N2O2 MolecularWeight: 320.385

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NN1C)C)CC2=CC=C(C=C2)OC(=O)C3=CC=CC=C3

Isomeric SMILES

CC1=C(C(=NN1C)C)CC2=CC=C(C=C2)OC(=O)C3=CC=CC=C3

InChI

InChI=1S/C20H20N2O2/c1-14-19(15(2)22(3)21-14)13-16-9-11-18(12-10-16)24-20(23)17-7-5-4-6-8-17/h4-12H,13H2,1-3H3