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

Systemtic Name: methyl 4-[[4-chloranyl-3,5-bis(3-methylphenyl)pyrazol-1-yl]methyl]benzoate Openeye Name: methyl 4-[[4-chloro-3,5-bis(m-tolyl)pyrazol-1-yl]methyl]benzoate CAS Name: 4-[[4-chloro-3,5-bis(3-methylphenyl)-1-pyrazolyl]methyl]benzoic acid methyl ester IUPAC Name: methyl 4-[[4-chloro-3,5-bis(3-methylphenyl)pyrazol-1-yl]methyl]benzoate Traditional Name: 4-[[4-chloro-3,5-bis(m-tolyl)pyrazol-1-yl]methyl]benzoic acid methyl ester Formula: C26H23ClN2O2 MolecularWeight: 430.92602

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC(=C1)C2=C(C(=NN2CC3=CC=C(C=C3)C(=O)OC)C4=CC(=CC=C4)C)Cl

Isomeric SMILES

CC1=CC=CC(=C1)C2=C(C(=NN2CC3=CC=C(C=C3)C(=O)OC)C4=CC(=CC=C4)C)Cl

InChI

InChI=1S/C26H23ClN2O2/c1-17-6-4-8-21(14-17)24-23(27)25(22-9-5-7-18(2)15-22)29(28-24)16-19-10-12-20(13-11-19)26(30)31-3/h4-15H,16H2,1-3H3