N-[4-chloranyl-2-(phenylcarbonyl)phenyl]-2-(3,5-dimethyl-4-nitro-pyrazol-1-yl)ethanamide

Systemtic Name: N-[4-chloranyl-2-(phenylcarbonyl)phenyl]-2-(3,5-dimethyl-4-nitro-pyrazol-1-yl)ethanamide Openeye Name: N-(2-benzoyl-4-chloro-phenyl)-2-(3,5-dimethyl-4-nitro-pyrazol-1-yl)acetamide CAS Name: N-(2-benzoyl-4-chlorophenyl)-2-(3,5-dimethyl-4-nitro-1-pyrazolyl)acetamide IUPAC Name: N-(2-benzoyl-4-chlorophenyl)-2-(3,5-dimethyl-4-nitropyrazol-1-yl)acetamide Traditional Name: N-(2-benzoyl-4-chloro-phenyl)-2-(3,5-dimethyl-4-nitro-pyrazol-1-yl)acetamide Formula: C20H17ClN4O4 MolecularWeight: 412.82638

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NN1CC(=O)NC2=C(C=C(C=C2)Cl)C(=O)C3=CC=CC=C3)C)[N+](=O)[O-]

Isomeric SMILES

CC1=C(C(=NN1CC(=O)NC2=C(C=C(C=C2)Cl)C(=O)C3=CC=CC=C3)C)[N+](=O)[O-]

InChI

InChI=1S/C20H17ClN4O4/c1-12-19(25(28)29)13(2)24(23-12)11-18(26)22-17-9-8-15(21)10-16(17)20(27)14-6-4-3-5-7-14/h3-10H,11H2,1-2H3,(H,22,26)