3-(4-bromophenyl)-1-(4-methoxyphenyl)-5-methyl-pyrazole-4-carboxylic acid

Systemtic Name: 3-(4-bromophenyl)-1-(4-methoxyphenyl)-5-methyl-pyrazole-4-carboxylic acid Openeye Name: 3-(4-bromophenyl)-1-(4-methoxyphenyl)-5-methyl-pyrazole-4-carboxylic acid CAS Name: 3-(4-bromophenyl)-1-(4-methoxyphenyl)-5-methyl-4-pyrazolecarboxylic acid IUPAC Name: 3-(4-bromophenyl)-1-(4-methoxyphenyl)-5-methylpyrazole-4-carboxylic acid Traditional Name: 3-(4-bromophenyl)-1-(4-methoxyphenyl)-5-methyl-pyrazole-4-carboxylic acid Formula: C18H15BrN2O3 MolecularWeight: 387.2273

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NN1C2=CC=C(C=C2)OC)C3=CC=C(C=C3)Br)C(=O)O

Isomeric SMILES

CC1=C(C(=NN1C2=CC=C(C=C2)OC)C3=CC=C(C=C3)Br)C(=O)O

InChI

InChI=1S/C18H15BrN2O3/c1-11-16(18(22)23)17(12-3-5-13(19)6-4-12)20-21(11)14-7-9-15(24-2)10-8-14/h3-10H,1-2H3,(H,22,23)