3-(4-bromanyl-3-nitro-pyrazol-1-yl)-N-(3-methoxyphenyl)propanamide

Systemtic Name: 3-(4-bromanyl-3-nitro-pyrazol-1-yl)-N-(3-methoxyphenyl)propanamide Openeye Name: 3-(4-bromo-3-nitro-pyrazol-1-yl)-N-(3-methoxyphenyl)propanamide CAS Name: 3-(4-bromo-3-nitro-1-pyrazolyl)-N-(3-methoxyphenyl)propanamide IUPAC Name: 3-(4-bromo-3-nitropyrazol-1-yl)-N-(3-methoxyphenyl)propanamide Traditional Name: 3-(4-bromo-3-nitro-pyrazol-1-yl)-N-(3-methoxyphenyl)propionamide Formula: C13H13BrN4O4 MolecularWeight: 369.17072

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC(=C1)NC(=O)CCN2C=C(C(=N2)[N+](=O)[O-])Br

Isomeric SMILES

COC1=CC=CC(=C1)NC(=O)CCN2C=C(C(=N2)[N+](=O)[O-])Br

InChI

InChI=1S/C13H13BrN4O4/c1-22-10-4-2-3-9(7-10)15-12(19)5-6-17-8-11(14)13(16-17)18(20)21/h2-4,7-8H,5-6H2,1H3,(H,15,19)