2-(4-chloranyl-3,5-dimethyl-pyrazol-1-yl)-N-(5-nitro-2-oxidanyl-phenyl)propanamide

Systemtic Name: 2-(4-chloranyl-3,5-dimethyl-pyrazol-1-yl)-N-(5-nitro-2-oxidanyl-phenyl)propanamide Openeye Name: 2-(4-chloro-3,5-dimethyl-pyrazol-1-yl)-N-(2-hydroxy-5-nitro-phenyl)propanamide CAS Name: 2-(4-chloro-3,5-dimethyl-1-pyrazolyl)-N-(2-hydroxy-5-nitrophenyl)propanamide IUPAC Name: 2-(4-chloro-3,5-dimethylpyrazol-1-yl)-N-(2-hydroxy-5-nitrophenyl)propanamide Traditional Name: 2-(4-chloro-3,5-dimethyl-pyrazol-1-yl)-N-(2-hydroxy-5-nitro-phenyl)propionamide Formula: C14H15ClN4O4 MolecularWeight: 338.7463

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C14H15ClN4O4/c1-7-13(15)8(2)18(17-7)9(3)14(21)16-11-6-10(19(22)23)4-5-12(11)20/h4-6,9,20H,1-3H3,(H,16,21)