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

Systemtic Name: methyl 3-[[4-bromanyl-3,5-bis(4-methylphenyl)pyrazol-1-yl]methyl]benzoate Openeye Name: methyl 3-[[4-bromo-3,5-bis(p-tolyl)pyrazol-1-yl]methyl]benzoate CAS Name: 3-[[4-bromo-3,5-bis(4-methylphenyl)-1-pyrazolyl]methyl]benzoic acid methyl ester IUPAC Name: methyl 3-[[4-bromo-3,5-bis(4-methylphenyl)pyrazol-1-yl]methyl]benzoate Traditional Name: 3-[[4-bromo-3,5-bis(p-tolyl)pyrazol-1-yl]methyl]benzoic acid methyl ester Formula: C26H23BrN2O2 MolecularWeight: 475.37702

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C26H23BrN2O2/c1-17-7-11-20(12-8-17)24-23(27)25(21-13-9-18(2)10-14-21)29(28-24)16-19-5-4-6-22(15-19)26(30)31-3/h4-15H,16H2,1-3H3