5-aminocarbonyl-1-(3-bromanyl-5-methyl-phenyl)pyrazole-4-carboxylic acid

Systemtic Name: 5-aminocarbonyl-1-(3-bromanyl-5-methyl-phenyl)pyrazole-4-carboxylic acid Openeye Name: 1-(3-bromo-5-methyl-phenyl)-5-carbamoyl-pyrazole-4-carboxylic acid CAS Name: 1-(3-bromo-5-methylphenyl)-5-carbamoyl-4-pyrazolecarboxylic acid IUPAC Name: 1-(3-bromo-5-methylphenyl)-5-carbamoylpyrazole-4-carboxylic acid Traditional Name: 1-(3-bromo-5-methyl-phenyl)-5-carbamoyl-pyrazole-4-carboxylic acid Formula: C12H10BrN3O3 MolecularWeight: 324.1301

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1)Br)N2C(=C(C=N2)C(=O)O)C(=O)N

Isomeric SMILES

CC1=CC(=CC(=C1)Br)N2C(=C(C=N2)C(=O)O)C(=O)N

InChI

InChI=1S/C12H10BrN3O3/c1-6-2-7(13)4-8(3-6)16-10(11(14)17)9(5-15-16)12(18)19/h2-5H,1H3,(H2,14,17)(H,18,19)