[2-(4-methylphenyl)-5-propan-2-yl-pyrazol-3-yl] 3-bromanylbenzoate

Systemtic Name: [2-(4-methylphenyl)-5-propan-2-yl-pyrazol-3-yl] 3-bromanylbenzoate Openeye Name: [5-isopropyl-2-(p-tolyl)pyrazol-3-yl] 3-bromobenzoate CAS Name: 3-bromobenzoic acid [2-(4-methylphenyl)-5-propan-2-yl-3-pyrazolyl] ester IUPAC Name: [2-(4-methylphenyl)-5-propan-2-ylpyrazol-3-yl] 3-bromobenzoate Traditional Name: 3-bromobenzoic acid [5-isopropyl-2-(p-tolyl)pyrazol-3-yl] ester Formula: C20H19BrN2O2 MolecularWeight: 399.28106

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)N2C(=CC(=N2)C(C)C)OC(=O)C3=CC(=CC=C3)Br

Isomeric SMILES

CC1=CC=C(C=C1)N2C(=CC(=N2)C(C)C)OC(=O)C3=CC(=CC=C3)Br

InChI

InChI=1S/C20H19BrN2O2/c1-13(2)18-12-19(23(22-18)17-9-7-14(3)8-10-17)25-20(24)15-5-4-6-16(21)11-15/h4-13H,1-3H3