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

Systemtic Name: 2-(4-chloranyl-3,5-dimethyl-pyrazol-1-yl)-N-(2-cyano-4-nitro-phenyl)propanamide Openeye Name: 2-(4-chloro-3,5-dimethyl-pyrazol-1-yl)-N-(2-cyano-4-nitro-phenyl)propanamide CAS Name: 2-(4-chloro-3,5-dimethyl-1-pyrazolyl)-N-(2-cyano-4-nitrophenyl)propanamide IUPAC Name: 2-(4-chloro-3,5-dimethylpyrazol-1-yl)-N-(2-cyano-4-nitrophenyl)propanamide Traditional Name: 2-(4-chloro-3,5-dimethyl-pyrazol-1-yl)-N-(2-cyano-4-nitro-phenyl)propionamide Formula: C15H14ClN5O3 MolecularWeight: 347.75636

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C15H14ClN5O3/c1-8-14(16)9(2)20(19-8)10(3)15(22)18-13-5-4-12(21(23)24)6-11(13)7-17/h4-6,10H,1-3H3,(H,18,22)