N-(1,5-dimethyl-3-oxidanylidene-2-phenyl-pyrazol-4-yl)-4-(5-methyl-3-nitro-pyrazol-1-yl)butanamide

Systemtic Name: N-(1,5-dimethyl-3-oxidanylidene-2-phenyl-pyrazol-4-yl)-4-(5-methyl-3-nitro-pyrazol-1-yl)butanamide Openeye Name: N-(1,5-dimethyl-3-oxo-2-phenyl-pyrazol-4-yl)-4-(5-methyl-3-nitro-pyrazol-1-yl)butanamide CAS Name: N-(1,5-dimethyl-3-oxo-2-phenyl-4-pyrazolyl)-4-(5-methyl-3-nitro-1-pyrazolyl)butanamide IUPAC Name: N-(1,5-dimethyl-3-oxo-2-phenylpyrazol-4-yl)-4-(5-methyl-3-nitropyrazol-1-yl)butanamide Traditional Name: N-(3-keto-1,5-dimethyl-2-phenyl-3-pyrazolin-4-yl)-4-(5-methyl-3-nitro-pyrazol-1-yl)butyramide Formula: C19H22N6O4 MolecularWeight: 398.41578

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NN1CCCC(=O)NC2=C(N(N(C2=O)C3=CC=CC=C3)C)C)[N+](=O)[O-]

Isomeric SMILES

CC1=CC(=NN1CCCC(=O)NC2=C(N(N(C2=O)C3=CC=CC=C3)C)C)[N+](=O)[O-]

InChI

InChI=1S/C19H22N6O4/c1-13-12-16(25(28)29)21-23(13)11-7-10-17(26)20-18-14(2)22(3)24(19(18)27)15-8-5-4-6-9-15/h4-6,8-9,12H,7,10-11H2,1-3H3,(H,20,26)