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

Systemtic Name: [5-tert-butyl-2-(4-chlorophenyl)pyrazol-3-yl] 3-methoxybenzoate Openeye Name: [5-tert-butyl-2-(4-chlorophenyl)pyrazol-3-yl] 3-methoxybenzoate CAS Name: 3-methoxybenzoic acid [5-tert-butyl-2-(4-chlorophenyl)-3-pyrazolyl] ester IUPAC Name: [5-tert-butyl-2-(4-chlorophenyl)pyrazol-3-yl] 3-methoxybenzoate Traditional Name: 3-methoxybenzoic acid [5-tert-butyl-2-(4-chlorophenyl)pyrazol-3-yl] ester Formula: C21H21ClN2O3 MolecularWeight: 384.85604

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=NN(C(=C1)OC(=O)C2=CC(=CC=C2)OC)C3=CC=C(C=C3)Cl

Isomeric SMILES

CC(C)(C)C1=NN(C(=C1)OC(=O)C2=CC(=CC=C2)OC)C3=CC=C(C=C3)Cl

InChI

InChI=1S/C21H21ClN2O3/c1-21(2,3)18-13-19(24(23-18)16-10-8-15(22)9-11-16)27-20(25)14-6-5-7-17(12-14)26-4/h5-13H,1-4H3