N-[3-[(4-chloranylpyrazol-1-yl)methyl]phenyl]-2-(4-nitropyrazol-1-yl)butanamide

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

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C(=O)NC1=CC=CC(=C1)CN2C=C(C=N2)Cl)N3C=C(C=N3)[N+](=O)[O-]

Isomeric SMILES

CCC(C(=O)NC1=CC=CC(=C1)CN2C=C(C=N2)Cl)N3C=C(C=N3)[N+](=O)[O-]

InChI

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