N-[1-[(2-chloranyl-4-fluoranyl-phenyl)methyl]pyrazol-4-yl]-3-(5-methyl-3-nitro-pyrazol-1-yl)propanamide

Systemtic Name: N-[1-[(2-chloranyl-4-fluoranyl-phenyl)methyl]pyrazol-4-yl]-3-(5-methyl-3-nitro-pyrazol-1-yl)propanamide Openeye Name: N-[1-[(2-chloro-4-fluoro-phenyl)methyl]pyrazol-4-yl]-3-(5-methyl-3-nitro-pyrazol-1-yl)propanamide CAS Name: N-[1-[(2-chloro-4-fluorophenyl)methyl]-4-pyrazolyl]-3-(5-methyl-3-nitro-1-pyrazolyl)propanamide IUPAC Name: N-[1-[(2-chloro-4-fluorophenyl)methyl]pyrazol-4-yl]-3-(5-methyl-3-nitropyrazol-1-yl)propanamide Traditional Name: N-[1-(2-chloro-4-fluoro-benzyl)pyrazol-4-yl]-3-(5-methyl-3-nitro-pyrazol-1-yl)propionamide Formula: C17H16ClFN6O3 MolecularWeight: 406.798743

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NN1CCC(=O)NC2=CN(N=C2)CC3=C(C=C(C=C3)F)Cl)[N+](=O)[O-]

Isomeric SMILES

CC1=CC(=NN1CCC(=O)NC2=CN(N=C2)CC3=C(C=C(C=C3)F)Cl)[N+](=O)[O-]

InChI

InChI=1S/C17H16ClFN6O3/c1-11-6-16(25(27)28)22-24(11)5-4-17(26)21-14-8-20-23(10-14)9-12-2-3-13(19)7-15(12)18/h2-3,6-8,10H,4-5,9H2,1H3,(H,21,26)