3-(4-bromophenyl)-1-(4-methoxyphenyl)-5-propan-2-yl-pyrazole-4-carboxylic acid

Systemtic Name: 3-(4-bromophenyl)-1-(4-methoxyphenyl)-5-propan-2-yl-pyrazole-4-carboxylic acid Openeye Name: 3-(4-bromophenyl)-5-isopropyl-1-(4-methoxyphenyl)pyrazole-4-carboxylic acid CAS Name: 3-(4-bromophenyl)-1-(4-methoxyphenyl)-5-propan-2-yl-4-pyrazolecarboxylic acid IUPAC Name: 3-(4-bromophenyl)-1-(4-methoxyphenyl)-5-propan-2-ylpyrazole-4-carboxylic acid Traditional Name: 3-(4-bromophenyl)-5-isopropyl-1-(4-methoxyphenyl)pyrazole-4-carboxylic acid Formula: C20H19BrN2O3 MolecularWeight: 415.28046

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=C(C(=NN1C2=CC=C(C=C2)OC)C3=CC=C(C=C3)Br)C(=O)O

Isomeric SMILES

CC(C)C1=C(C(=NN1C2=CC=C(C=C2)OC)C3=CC=C(C=C3)Br)C(=O)O

InChI

InChI=1S/C20H19BrN2O3/c1-12(2)19-17(20(24)25)18(13-4-6-14(21)7-5-13)22-23(19)15-8-10-16(26-3)11-9-15/h4-12H,1-3H3,(H,24,25)