N-(4-bromanyl-2-fluoranyl-phenyl)-3-(4-chloranyl-3-nitro-pyrazol-1-yl)propanamide

Systemtic Name: N-(4-bromanyl-2-fluoranyl-phenyl)-3-(4-chloranyl-3-nitro-pyrazol-1-yl)propanamide Openeye Name: N-(4-bromo-2-fluoro-phenyl)-3-(4-chloro-3-nitro-pyrazol-1-yl)propanamide CAS Name: N-(4-bromo-2-fluorophenyl)-3-(4-chloro-3-nitro-1-pyrazolyl)propanamide IUPAC Name: N-(4-bromo-2-fluorophenyl)-3-(4-chloro-3-nitropyrazol-1-yl)propanamide Traditional Name: N-(4-bromo-2-fluoro-phenyl)-3-(4-chloro-3-nitro-pyrazol-1-yl)propionamide Formula: C12H9BrClFN4O3 MolecularWeight: 391.580263

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(C=C1Br)F)NC(=O)CCN2C=C(C(=N2)[N+](=O)[O-])Cl

Isomeric SMILES

C1=CC(=C(C=C1Br)F)NC(=O)CCN2C=C(C(=N2)[N+](=O)[O-])Cl

InChI

InChI=1S/C12H9BrClFN4O3/c13-7-1-2-10(9(15)5-7)16-11(20)3-4-18-6-8(14)12(17-18)19(21)22/h1-2,5-6H,3-4H2,(H,16,20)