[5-tert-butyl-2-(4-chlorophenyl)pyrazol-3-yl] 4-methylbenzoate

Systemtic Name: [5-tert-butyl-2-(4-chlorophenyl)pyrazol-3-yl] 4-methylbenzoate Openeye Name: [5-tert-butyl-2-(4-chlorophenyl)pyrazol-3-yl] 4-methylbenzoate CAS Name: 4-methylbenzoic acid [5-tert-butyl-2-(4-chlorophenyl)-3-pyrazolyl] ester IUPAC Name: [5-tert-butyl-2-(4-chlorophenyl)pyrazol-3-yl] 4-methylbenzoate Traditional Name: 4-methylbenzoic acid [5-tert-butyl-2-(4-chlorophenyl)pyrazol-3-yl] ester Formula: C21H21ClN2O2 MolecularWeight: 368.85664

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C(=O)OC2=CC(=NN2C3=CC=C(C=C3)Cl)C(C)(C)C

Isomeric SMILES

CC1=CC=C(C=C1)C(=O)OC2=CC(=NN2C3=CC=C(C=C3)Cl)C(C)(C)C

InChI

InChI=1S/C21H21ClN2O2/c1-14-5-7-15(8-6-14)20(25)26-19-13-18(21(2,3)4)23-24(19)17-11-9-16(22)10-12-17/h5-13H,1-4H3