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

Systemtic Name: N-[3-[(4-chloranylpyrazol-1-yl)methyl]phenyl]-2-(5-methyl-3-nitro-pyrazol-1-yl)propanamide Openeye Name: N-[3-[(4-chloropyrazol-1-yl)methyl]phenyl]-2-(5-methyl-3-nitro-pyrazol-1-yl)propanamide CAS Name: N-[3-[(4-chloro-1-pyrazolyl)methyl]phenyl]-2-(5-methyl-3-nitro-1-pyrazolyl)propanamide IUPAC Name: N-[3-[(4-chloropyrazol-1-yl)methyl]phenyl]-2-(5-methyl-3-nitropyrazol-1-yl)propanamide Traditional Name: N-[3-[(4-chloropyrazol-1-yl)methyl]phenyl]-2-(5-methyl-3-nitro-pyrazol-1-yl)propionamide Formula: C17H17ClN6O3 MolecularWeight: 388.80828

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NN1C(C)C(=O)NC2=CC=CC(=C2)CN3C=C(C=N3)Cl)[N+](=O)[O-]

Isomeric SMILES

CC1=CC(=NN1C(C)C(=O)NC2=CC=CC(=C2)CN3C=C(C=N3)Cl)[N+](=O)[O-]

InChI

InChI=1S/C17H17ClN6O3/c1-11-6-16(24(26)27)21-23(11)12(2)17(25)20-15-5-3-4-13(7-15)9-22-10-14(18)8-19-22/h3-8,10,12H,9H2,1-2H3,(H,20,25)