methyl 1-[[4-chloranyl-3,5-bis(4-methylphenyl)pyrazol-1-yl]methyl]pyrazole-3-carboxylate

Systemtic Name: methyl 1-[[4-chloranyl-3,5-bis(4-methylphenyl)pyrazol-1-yl]methyl]pyrazole-3-carboxylate Openeye Name: methyl 1-[[4-chloro-3,5-bis(p-tolyl)pyrazol-1-yl]methyl]pyrazole-3-carboxylate CAS Name: 1-[[4-chloro-3,5-bis(4-methylphenyl)-1-pyrazolyl]methyl]-3-pyrazolecarboxylic acid methyl ester IUPAC Name: methyl 1-[[4-chloro-3,5-bis(4-methylphenyl)pyrazol-1-yl]methyl]pyrazole-3-carboxylate Traditional Name: 1-[[4-chloro-3,5-bis(p-tolyl)pyrazol-1-yl]methyl]pyrazole-3-carboxylic acid methyl ester Formula: C23H21ClN4O2 MolecularWeight: 420.89144

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C2=C(C(=NN2CN3C=CC(=N3)C(=O)OC)C4=CC=C(C=C4)C)Cl

Isomeric SMILES

CC1=CC=C(C=C1)C2=C(C(=NN2CN3C=CC(=N3)C(=O)OC)C4=CC=C(C=C4)C)Cl

InChI

InChI=1S/C23H21ClN4O2/c1-15-4-8-17(9-5-15)21-20(24)22(18-10-6-16(2)7-11-18)28(26-21)14-27-13-12-19(25-27)23(29)30-3/h4-13H,14H2,1-3H3