propyl 5-aminocarbonyl-1-(3-bromanyl-5-methyl-phenyl)pyrazole-4-carboxylate

Systemtic Name: propyl 5-aminocarbonyl-1-(3-bromanyl-5-methyl-phenyl)pyrazole-4-carboxylate Openeye Name: propyl 1-(3-bromo-5-methyl-phenyl)-5-carbamoyl-pyrazole-4-carboxylate CAS Name: 1-(3-bromo-5-methylphenyl)-5-carbamoyl-4-pyrazolecarboxylic acid propyl ester IUPAC Name: propyl 1-(3-bromo-5-methylphenyl)-5-carbamoylpyrazole-4-carboxylate Traditional Name: 1-(3-bromo-5-methyl-phenyl)-5-carbamoyl-pyrazole-4-carboxylic acid propyl ester Formula: C15H16BrN3O3 MolecularWeight: 366.20984

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCOC(=O)C1=C(N(N=C1)C2=CC(=CC(=C2)C)Br)C(=O)N

Isomeric SMILES

CCCOC(=O)C1=C(N(N=C1)C2=CC(=CC(=C2)C)Br)C(=O)N

InChI

InChI=1S/C15H16BrN3O3/c1-3-4-22-15(21)12-8-18-19(13(12)14(17)20)11-6-9(2)5-10(16)7-11/h5-8H,3-4H2,1-2H3,(H2,17,20)