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

Systemtic Name: methyl 3-[[3,5-bis(4-bromophenyl)pyrazol-1-yl]methyl]benzoate Openeye Name: methyl 3-[[3,5-bis(4-bromophenyl)pyrazol-1-yl]methyl]benzoate CAS Name: 3-[[3,5-bis(4-bromophenyl)-1-pyrazolyl]methyl]benzoic acid methyl ester IUPAC Name: methyl 3-[[3,5-bis(4-bromophenyl)pyrazol-1-yl]methyl]benzoate Traditional Name: 3-[[3,5-bis(4-bromophenyl)pyrazol-1-yl]methyl]benzoic acid methyl ester Formula: C24H18Br2N2O2 MolecularWeight: 526.21992

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC(=CC=C1)CN2C(=CC(=N2)C3=CC=C(C=C3)Br)C4=CC=C(C=C4)Br

Isomeric SMILES

COC(=O)C1=CC(=CC=C1)CN2C(=CC(=N2)C3=CC=C(C=C3)Br)C4=CC=C(C=C4)Br

InChI

InChI=1S/C24H18Br2N2O2/c1-30-24(29)19-4-2-3-16(13-19)15-28-23(18-7-11-21(26)12-8-18)14-22(27-28)17-5-9-20(25)10-6-17/h2-14H,15H2,1H3