3-methylbutyl 3-(4-chlorophenyl)-1-phenyl-pyrazole-4-carboxylate

Systemtic Name: 3-methylbutyl 3-(4-chlorophenyl)-1-phenyl-pyrazole-4-carboxylate Openeye Name: isopentyl 3-(4-chlorophenyl)-1-phenyl-pyrazole-4-carboxylate CAS Name: 3-(4-chlorophenyl)-1-phenyl-4-pyrazolecarboxylic acid 3-methylbutyl ester IUPAC Name: 3-methylbutyl 3-(4-chlorophenyl)-1-phenylpyrazole-4-carboxylate Traditional Name: 3-(4-chlorophenyl)-1-phenyl-pyrazole-4-carboxylic acid isoamyl ester Formula: C21H21ClN2O2 MolecularWeight: 368.85664

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CCOC(=O)C1=CN(N=C1C2=CC=C(C=C2)Cl)C3=CC=CC=C3

Isomeric SMILES

CC(C)CCOC(=O)C1=CN(N=C1C2=CC=C(C=C2)Cl)C3=CC=CC=C3

InChI

InChI=1S/C21H21ClN2O2/c1-15(2)12-13-26-21(25)19-14-24(18-6-4-3-5-7-18)23-20(19)16-8-10-17(22)11-9-16/h3-11,14-15H,12-13H2,1-2H3