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

Systemtic Name: 3-(4-bromanyl-3-nitro-pyrazol-1-yl)-N-[1-[(2-chloranyl-4-fluoranyl-phenyl)methyl]pyrazol-3-yl]propanamide Openeye Name: 3-(4-bromo-3-nitro-pyrazol-1-yl)-N-[1-[(2-chloro-4-fluoro-phenyl)methyl]pyrazol-3-yl]propanamide CAS Name: 3-(4-bromo-3-nitro-1-pyrazolyl)-N-[1-[(2-chloro-4-fluorophenyl)methyl]-3-pyrazolyl]propanamide IUPAC Name: 3-(4-bromo-3-nitropyrazol-1-yl)-N-[1-[(2-chloro-4-fluorophenyl)methyl]pyrazol-3-yl]propanamide Traditional Name: 3-(4-bromo-3-nitro-pyrazol-1-yl)-N-[1-(2-chloro-4-fluoro-benzyl)pyrazol-3-yl]propionamide Formula: C16H13BrClFN6O3 MolecularWeight: 471.668223

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(C=C1F)Cl)CN2C=CC(=N2)NC(=O)CCN3C=C(C(=N3)[N+](=O)[O-])Br

Isomeric SMILES

C1=CC(=C(C=C1F)Cl)CN2C=CC(=N2)NC(=O)CCN3C=C(C(=N3)[N+](=O)[O-])Br

InChI

InChI=1S/C16H13BrClFN6O3/c17-12-9-24(22-16(12)25(27)28)6-4-15(26)20-14-3-5-23(21-14)8-10-1-2-11(19)7-13(10)18/h1-3,5,7,9H,4,6,8H2,(H,20,21,26)