tert-butyl 3-(4-chlorophenyl)-5-(4-methoxyphenyl)pyrazole-1-carboxylate

Systemtic Name: tert-butyl 3-(4-chlorophenyl)-5-(4-methoxyphenyl)pyrazole-1-carboxylate Openeye Name: tert-butyl 3-(4-chlorophenyl)-5-(4-methoxyphenyl)pyrazole-1-carboxylate CAS Name: 3-(4-chlorophenyl)-5-(4-methoxyphenyl)-1-pyrazolecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl 3-(4-chlorophenyl)-5-(4-methoxyphenyl)pyrazole-1-carboxylate Traditional Name: 3-(4-chlorophenyl)-5-(4-methoxyphenyl)pyrazole-1-carboxylic acid tert-butyl ester Formula: C21H21ClN2O3 MolecularWeight: 384.85604

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)N1C(=CC(=N1)C2=CC=C(C=C2)Cl)C3=CC=C(C=C3)OC

Isomeric SMILES

CC(C)(C)OC(=O)N1C(=CC(=N1)C2=CC=C(C=C2)Cl)C3=CC=C(C=C3)OC

InChI

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