4-chloranyl-N-[(3,5-dimethyl-1-phenyl-pyrazol-4-yl)methyl]-3-nitro-1H-pyrazole-5-carboxamide

Systemtic Name: 4-chloranyl-N-[(3,5-dimethyl-1-phenyl-pyrazol-4-yl)methyl]-3-nitro-1H-pyrazole-5-carboxamide Openeye Name: 4-chloro-N-[(3,5-dimethyl-1-phenyl-pyrazol-4-yl)methyl]-3-nitro-1H-pyrazole-5-carboxamide CAS Name: 4-chloro-N-[(3,5-dimethyl-1-phenyl-4-pyrazolyl)methyl]-3-nitro-1H-pyrazole-5-carboxamide IUPAC Name: 4-chloro-N-[(3,5-dimethyl-1-phenylpyrazol-4-yl)methyl]-3-nitro-1H-pyrazole-5-carboxamide Traditional Name: 4-chloro-N-[(3,5-dimethyl-1-phenyl-pyrazol-4-yl)methyl]-3-nitro-1H-pyrazole-5-carboxamide Formula: C16H15ClN6O3 MolecularWeight: 374.7817

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NN1C2=CC=CC=C2)C)CNC(=O)C3=C(C(=NN3)[N+](=O)[O-])Cl

Isomeric SMILES

CC1=C(C(=NN1C2=CC=CC=C2)C)CNC(=O)C3=C(C(=NN3)[N+](=O)[O-])Cl

InChI

InChI=1S/C16H15ClN6O3/c1-9-12(10(2)22(21-9)11-6-4-3-5-7-11)8-18-16(24)14-13(17)15(20-19-14)23(25)26/h3-7H,8H2,1-2H3,(H,18,24)(H,19,20)