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

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

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=NN1CCC(=O)NC2=CC=CC(=C2)CN3C=C(C=N3)Cl)[N+](=O)[O-]

Isomeric SMILES

CC1=C(C=NN1CCC(=O)NC2=CC=CC(=C2)CN3C=C(C=N3)Cl)[N+](=O)[O-]

InChI

InChI=1S/C17H17ClN6O3/c1-12-16(24(26)27)9-20-23(12)6-5-17(25)21-15-4-2-3-13(7-15)10-22-11-14(18)8-19-22/h2-4,7-9,11H,5-6,10H2,1H3,(H,21,25)