4-chloranyl-N-(3-methoxy-5-nitro-phenyl)-1-methyl-pyrazole-3-carboxamide

Systemtic Name: 4-chloranyl-N-(3-methoxy-5-nitro-phenyl)-1-methyl-pyrazole-3-carboxamide Openeye Name: 4-chloro-N-(3-methoxy-5-nitro-phenyl)-1-methyl-pyrazole-3-carboxamide CAS Name: 4-chloro-N-(3-methoxy-5-nitrophenyl)-1-methyl-3-pyrazolecarboxamide IUPAC Name: 4-chloro-N-(3-methoxy-5-nitrophenyl)-1-methylpyrazole-3-carboxamide Traditional Name: 4-chloro-N-(3-methoxy-5-nitro-phenyl)-1-methyl-pyrazole-3-carboxamide Formula: C12H11ClN4O4 MolecularWeight: 310.69314

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=C(C(=N1)C(=O)NC2=CC(=CC(=C2)OC)[N+](=O)[O-])Cl

Isomeric SMILES

CN1C=C(C(=N1)C(=O)NC2=CC(=CC(=C2)OC)[N+](=O)[O-])Cl

InChI

InChI=1S/C12H11ClN4O4/c1-16-6-10(13)11(15-16)12(18)14-7-3-8(17(19)20)5-9(4-7)21-2/h3-6H,1-2H3,(H,14,18)