2-(4-bromanyl-5-methyl-pyrazol-1-yl)-N-(4-methyl-3,5-dinitro-phenyl)propanamide

Systemtic Name: 2-(4-bromanyl-5-methyl-pyrazol-1-yl)-N-(4-methyl-3,5-dinitro-phenyl)propanamide Openeye Name: 2-(4-bromo-5-methyl-pyrazol-1-yl)-N-(4-methyl-3,5-dinitro-phenyl)propanamide CAS Name: 2-(4-bromo-5-methyl-1-pyrazolyl)-N-(4-methyl-3,5-dinitrophenyl)propanamide IUPAC Name: 2-(4-bromo-5-methylpyrazol-1-yl)-N-(4-methyl-3,5-dinitrophenyl)propanamide Traditional Name: 2-(4-bromo-5-methyl-pyrazol-1-yl)-N-(4-methyl-3,5-dinitro-phenyl)propionamide Formula: C14H14BrN5O5 MolecularWeight: 412.19546

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1[N+](=O)[O-])NC(=O)C(C)N2C(=C(C=N2)Br)C)[N+](=O)[O-]

Isomeric SMILES

CC1=C(C=C(C=C1[N+](=O)[O-])NC(=O)C(C)N2C(=C(C=N2)Br)C)[N+](=O)[O-]

InChI

InChI=1S/C14H14BrN5O5/c1-7-12(19(22)23)4-10(5-13(7)20(24)25)17-14(21)9(3)18-8(2)11(15)6-16-18/h4-6,9H,1-3H3,(H,17,21)