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

Systemtic Name: methyl 4-[[3,5-bis(4-bromophenyl)-4-methyl-pyrazol-1-yl]methyl]benzoate Openeye Name: methyl 4-[[3,5-bis(4-bromophenyl)-4-methyl-pyrazol-1-yl]methyl]benzoate CAS Name: 4-[[3,5-bis(4-bromophenyl)-4-methyl-1-pyrazolyl]methyl]benzoic acid methyl ester IUPAC Name: methyl 4-[[3,5-bis(4-bromophenyl)-4-methylpyrazol-1-yl]methyl]benzoate Traditional Name: 4-[[3,5-bis(4-bromophenyl)-4-methyl-pyrazol-1-yl]methyl]benzoic acid methyl ester Formula: C25H20Br2N2O2 MolecularWeight: 540.2465

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(N(N=C1C2=CC=C(C=C2)Br)CC3=CC=C(C=C3)C(=O)OC)C4=CC=C(C=C4)Br

Isomeric SMILES

CC1=C(N(N=C1C2=CC=C(C=C2)Br)CC3=CC=C(C=C3)C(=O)OC)C4=CC=C(C=C4)Br

InChI

InChI=1S/C25H20Br2N2O2/c1-16-23(18-7-11-21(26)12-8-18)28-29(24(16)19-9-13-22(27)14-10-19)15-17-3-5-20(6-4-17)25(30)31-2/h3-14H,15H2,1-2H3