[2-(2,4-dimethylphenyl)-5-propan-2-yl-pyrazol-3-yl] 2-ethylhexanoate

Systemtic Name: [2-(2,4-dimethylphenyl)-5-propan-2-yl-pyrazol-3-yl] 2-ethylhexanoate Openeye Name: [2-(2,4-dimethylphenyl)-5-isopropyl-pyrazol-3-yl] 2-ethylhexanoate CAS Name: 2-ethylhexanoic acid [2-(2,4-dimethylphenyl)-5-propan-2-yl-3-pyrazolyl] ester IUPAC Name: [2-(2,4-dimethylphenyl)-5-propan-2-ylpyrazol-3-yl] 2-ethylhexanoate Traditional Name: 2-ethylhexanoic acid [2-(2,4-dimethylphenyl)-5-isopropyl-pyrazol-3-yl] ester Formula: C22H32N2O2 MolecularWeight: 356.50168

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(CC)C(=O)OC1=CC(=NN1C2=C(C=C(C=C2)C)C)C(C)C

Isomeric SMILES

CCCCC(CC)C(=O)OC1=CC(=NN1C2=C(C=C(C=C2)C)C)C(C)C

InChI

InChI=1S/C22H32N2O2/c1-7-9-10-18(8-2)22(25)26-21-14-19(15(3)4)23-24(21)20-12-11-16(5)13-17(20)6/h11-15,18H,7-10H2,1-6H3