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

Systemtic Name: N-[1-[(2-chloranyl-6-fluoranyl-phenyl)methyl]pyrazol-3-yl]-3-(3-nitropyrazol-1-yl)propanamide Openeye Name: N-[1-[(2-chloro-6-fluoro-phenyl)methyl]pyrazol-3-yl]-3-(3-nitropyrazol-1-yl)propanamide CAS Name: N-[1-[(2-chloro-6-fluorophenyl)methyl]-3-pyrazolyl]-3-(3-nitro-1-pyrazolyl)propanamide IUPAC Name: N-[1-[(2-chloro-6-fluorophenyl)methyl]pyrazol-3-yl]-3-(3-nitropyrazol-1-yl)propanamide Traditional Name: N-[1-(2-chloro-6-fluoro-benzyl)pyrazol-3-yl]-3-(3-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=CC(=N3)[N+](=O)[O-])F

Isomeric SMILES

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

InChI

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