2-(4-bromanyl-3,5-dimethyl-pyrazol-1-yl)-N-(4-ethoxy-2-nitro-phenyl)propanamide

Systemtic Name: 2-(4-bromanyl-3,5-dimethyl-pyrazol-1-yl)-N-(4-ethoxy-2-nitro-phenyl)propanamide Openeye Name: 2-(4-bromo-3,5-dimethyl-pyrazol-1-yl)-N-(4-ethoxy-2-nitro-phenyl)propanamide CAS Name: 2-(4-bromo-3,5-dimethyl-1-pyrazolyl)-N-(4-ethoxy-2-nitrophenyl)propanamide IUPAC Name: 2-(4-bromo-3,5-dimethylpyrazol-1-yl)-N-(4-ethoxy-2-nitrophenyl)propanamide Traditional Name: 2-(4-bromo-3,5-dimethyl-pyrazol-1-yl)-N-(4-ethoxy-2-nitro-phenyl)propionamide Formula: C16H19BrN4O4 MolecularWeight: 411.25046

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC(=C(C=C1)NC(=O)C(C)N2C(=C(C(=N2)C)Br)C)[N+](=O)[O-]

Isomeric SMILES

CCOC1=CC(=C(C=C1)NC(=O)C(C)N2C(=C(C(=N2)C)Br)C)[N+](=O)[O-]

InChI

InChI=1S/C16H19BrN4O4/c1-5-25-12-6-7-13(14(8-12)21(23)24)18-16(22)11(4)20-10(3)15(17)9(2)19-20/h6-8,11H,5H2,1-4H3,(H,18,22)