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

Systemtic Name: N-[1-[(2-chloranyl-6-fluoranyl-phenyl)methyl]pyrazol-3-yl]-3-(4-nitropyrazol-1-yl)propanamide Openeye Name: N-[1-[(2-chloro-6-fluoro-phenyl)methyl]pyrazol-3-yl]-3-(4-nitropyrazol-1-yl)propanamide CAS Name: N-[1-[(2-chloro-6-fluorophenyl)methyl]-3-pyrazolyl]-3-(4-nitro-1-pyrazolyl)propanamide IUPAC Name: N-[1-[(2-chloro-6-fluorophenyl)methyl]pyrazol-3-yl]-3-(4-nitropyrazol-1-yl)propanamide Traditional Name: N-[1-(2-chloro-6-fluoro-benzyl)pyrazol-3-yl]-3-(4-nitropyrazol-1-yl)propionamide Formula: C16H14ClFN6O3 MolecularWeight: 392.772163

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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-])F

Isomeric SMILES

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

InChI

InChI=1S/C16H14ClFN6O3/c17-13-2-1-3-14(18)12(13)10-23-6-4-15(21-23)20-16(25)5-7-22-9-11(8-19-22)24(26)27/h1-4,6,8-9H,5,7,10H2,(H,20,21,25)