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

Systemtic Name: N-[4-bromanyl-1-[(2-chloranyl-6-fluoranyl-phenyl)methyl]pyrazol-3-yl]-3-(3-nitropyrazol-1-yl)propanamide Openeye Name: N-[4-bromo-1-[(2-chloro-6-fluoro-phenyl)methyl]pyrazol-3-yl]-3-(3-nitropyrazol-1-yl)propanamide CAS Name: N-[4-bromo-1-[(2-chloro-6-fluorophenyl)methyl]-3-pyrazolyl]-3-(3-nitro-1-pyrazolyl)propanamide IUPAC Name: N-[4-bromo-1-[(2-chloro-6-fluorophenyl)methyl]pyrazol-3-yl]-3-(3-nitropyrazol-1-yl)propanamide Traditional Name: N-[4-bromo-1-(2-chloro-6-fluoro-benzyl)pyrazol-3-yl]-3-(3-nitropyrazol-1-yl)propionamide Formula: C16H13BrClFN6O3 MolecularWeight: 471.668223

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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