1-(4-ethylphenyl)-5-(4-propan-2-ylphenyl)pyrazole-3-carboxylate

Systemtic Name: 1-(4-ethylphenyl)-5-(4-propan-2-ylphenyl)pyrazole-3-carboxylate Openeye Name: 1-(4-ethylphenyl)-5-(4-isopropylphenyl)pyrazole-3-carboxylate CAS Name: 1-(4-ethylphenyl)-5-(4-propan-2-ylphenyl)-3-pyrazolecarboxylate IUPAC Name: 1-(4-ethylphenyl)-5-(4-propan-2-ylphenyl)pyrazole-3-carboxylate Traditional Name: 1-(4-ethylphenyl)-5-p-cumenyl-pyrazole-3-carboxylate Formula: C21H21N2O2- MolecularWeight: 333.40364

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(C=C1)N2C(=CC(=N2)C(=O)[O-])C3=CC=C(C=C3)C(C)C

Isomeric SMILES

CCC1=CC=C(C=C1)N2C(=CC(=N2)C(=O)[O-])C3=CC=C(C=C3)C(C)C

InChI

InChI=1S/C21H22N2O2/c1-4-15-5-11-18(12-6-15)23-20(13-19(22-23)21(24)25)17-9-7-16(8-10-17)14(2)3/h5-14H,4H2,1-3H3,(H,24,25)/p-1