N-(3-chloranyl-2-methyl-phenyl)-3-methoxy-4-nitro-1H-pyrazole-5-carboxamide

Systemtic Name: N-(3-chloranyl-2-methyl-phenyl)-3-methoxy-4-nitro-1H-pyrazole-5-carboxamide Openeye Name: N-(3-chloro-2-methyl-phenyl)-3-methoxy-4-nitro-1H-pyrazole-5-carboxamide CAS Name: N-(3-chloro-2-methylphenyl)-3-methoxy-4-nitro-1H-pyrazole-5-carboxamide IUPAC Name: N-(3-chloro-2-methylphenyl)-3-methoxy-4-nitro-1H-pyrazole-5-carboxamide Traditional Name: N-(3-chloro-2-methyl-phenyl)-3-methoxy-4-nitro-1H-pyrazole-5-carboxamide Formula: C12H11ClN4O4 MolecularWeight: 310.69314

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC=C1Cl)NC(=O)C2=C(C(=NN2)OC)[N+](=O)[O-]

Isomeric SMILES

CC1=C(C=CC=C1Cl)NC(=O)C2=C(C(=NN2)OC)[N+](=O)[O-]

InChI

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