1-(2-chlorophenyl)-3,5-di(propan-2-yl)pyrazole-4-carboxylate

Systemtic Name: 1-(2-chlorophenyl)-3,5-di(propan-2-yl)pyrazole-4-carboxylate Openeye Name: 1-(2-chlorophenyl)-3,5-diisopropyl-pyrazole-4-carboxylate CAS Name: 1-(2-chlorophenyl)-3,5-di(propan-2-yl)-4-pyrazolecarboxylate IUPAC Name: 1-(2-chlorophenyl)-3,5-di(propan-2-yl)pyrazole-4-carboxylate Traditional Name: 1-(2-chlorophenyl)-3,5-diisopropyl-pyrazole-4-carboxylate Formula: C16H18ClN2O2- MolecularWeight: 305.77932

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=C(C(=NN1C2=CC=CC=C2Cl)C(C)C)C(=O)[O-]

Isomeric SMILES

CC(C)C1=C(C(=NN1C2=CC=CC=C2Cl)C(C)C)C(=O)[O-]

InChI

InChI=1S/C16H19ClN2O2/c1-9(2)14-13(16(20)21)15(10(3)4)19(18-14)12-8-6-5-7-11(12)17/h5-10H,1-4H3,(H,20,21)/p-1