3-(4-bromanyl-3-nitro-pyrazol-1-yl)-N-[2-(trifluoromethyl)phenyl]propanamide

Systemtic Name: 3-(4-bromanyl-3-nitro-pyrazol-1-yl)-N-[2-(trifluoromethyl)phenyl]propanamide Openeye Name: 3-(4-bromo-3-nitro-pyrazol-1-yl)-N-[2-(trifluoromethyl)phenyl]propanamide CAS Name: 3-(4-bromo-3-nitro-1-pyrazolyl)-N-[2-(trifluoromethyl)phenyl]propanamide IUPAC Name: 3-(4-bromo-3-nitropyrazol-1-yl)-N-[2-(trifluoromethyl)phenyl]propanamide Traditional Name: 3-(4-bromo-3-nitro-pyrazol-1-yl)-N-[2-(trifluoromethyl)phenyl]propionamide Formula: C13H10BrF3N4O3 MolecularWeight: 407.14271

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C13H10BrF3N4O3/c14-9-7-20(19-12(9)21(23)24)6-5-11(22)18-10-4-2-1-3-8(10)13(15,16)17/h1-4,7H,5-6H2,(H,18,22)