3-(4-bromanyl-3-nitro-pyrazol-1-yl)-N-[1-[(2-chloranyl-6-fluoranyl-phenyl)methyl]pyrazol-3-yl]propanamide

Systemtic Name: 3-(4-bromanyl-3-nitro-pyrazol-1-yl)-N-[1-[(2-chloranyl-6-fluoranyl-phenyl)methyl]pyrazol-3-yl]propanamide Openeye Name: 3-(4-bromo-3-nitro-pyrazol-1-yl)-N-[1-[(2-chloro-6-fluoro-phenyl)methyl]pyrazol-3-yl]propanamide CAS Name: 3-(4-bromo-3-nitro-1-pyrazolyl)-N-[1-[(2-chloro-6-fluorophenyl)methyl]-3-pyrazolyl]propanamide IUPAC Name: 3-(4-bromo-3-nitropyrazol-1-yl)-N-[1-[(2-chloro-6-fluorophenyl)methyl]pyrazol-3-yl]propanamide Traditional Name: 3-(4-bromo-3-nitro-pyrazol-1-yl)-N-[1-(2-chloro-6-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(=C1)Cl)CN2C=CC(=N2)NC(=O)CCN3C=C(C(=N3)[N+](=O)[O-])Br)F

Isomeric SMILES

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

InChI

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