N-[4-[bis(fluoranyl)methoxy]-2-methyl-phenyl]-3-(4-bromanyl-3-nitro-pyrazol-1-yl)propanamide

Systemtic Name: N-[4-[bis(fluoranyl)methoxy]-2-methyl-phenyl]-3-(4-bromanyl-3-nitro-pyrazol-1-yl)propanamide Openeye Name: 3-(4-bromo-3-nitro-pyrazol-1-yl)-N-[4-(difluoromethoxy)-2-methyl-phenyl]propanamide CAS Name: 3-(4-bromo-3-nitro-1-pyrazolyl)-N-[4-(difluoromethoxy)-2-methylphenyl]propanamide IUPAC Name: 3-(4-bromo-3-nitropyrazol-1-yl)-N-[4-(difluoromethoxy)-2-methylphenyl]propanamide Traditional Name: 3-(4-bromo-3-nitro-pyrazol-1-yl)-N-[4-(difluoromethoxy)-2-methyl-phenyl]propionamide Formula: C14H13BrF2N4O4 MolecularWeight: 419.178226

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)OC(F)F)NC(=O)CCN2C=C(C(=N2)[N+](=O)[O-])Br

Isomeric SMILES

CC1=C(C=CC(=C1)OC(F)F)NC(=O)CCN2C=C(C(=N2)[N+](=O)[O-])Br

InChI

InChI=1S/C14H13BrF2N4O4/c1-8-6-9(25-14(16)17)2-3-11(8)18-12(22)4-5-20-7-10(15)13(19-20)21(23)24/h2-3,6-7,14H,4-5H2,1H3,(H,18,22)