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

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

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1N2C(=CC(=N2)C(C)C)OC(=O)C3=CC=C(C=C3)Br

Isomeric SMILES

CC1=CC=CC=C1N2C(=CC(=N2)C(C)C)OC(=O)C3=CC=C(C=C3)Br

InChI

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