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

Systemtic Name: methyl 4-[[3,5-bis(3-bromophenyl)-4-chloranyl-pyrazol-1-yl]methyl]benzoate Openeye Name: methyl 4-[[3,5-bis(3-bromophenyl)-4-chloro-pyrazol-1-yl]methyl]benzoate CAS Name: 4-[[3,5-bis(3-bromophenyl)-4-chloro-1-pyrazolyl]methyl]benzoic acid methyl ester IUPAC Name: methyl 4-[[3,5-bis(3-bromophenyl)-4-chloropyrazol-1-yl]methyl]benzoate Traditional Name: 4-[[3,5-bis(3-bromophenyl)-4-chloro-pyrazol-1-yl]methyl]benzoic acid methyl ester Formula: C24H17Br2ClN2O2 MolecularWeight: 560.66498

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C24H17Br2ClN2O2/c1-31-24(30)16-10-8-15(9-11-16)14-29-23(18-5-3-7-20(26)13-18)21(27)22(28-29)17-4-2-6-19(25)12-17/h2-13H,14H2,1H3