1-[(2-chloranyl-4-nitro-phenoxy)methyl]-N-(1-methylpyrazol-3-yl)pyrazole-3-carboxamide

Systemtic Name: 1-[(2-chloranyl-4-nitro-phenoxy)methyl]-N-(1-methylpyrazol-3-yl)pyrazole-3-carboxamide Openeye Name: 1-[(2-chloro-4-nitro-phenoxy)methyl]-N-(1-methylpyrazol-3-yl)pyrazole-3-carboxamide CAS Name: 1-[(2-chloro-4-nitrophenoxy)methyl]-N-(1-methyl-3-pyrazolyl)-3-pyrazolecarboxamide IUPAC Name: 1-[(2-chloro-4-nitrophenoxy)methyl]-N-(1-methylpyrazol-3-yl)pyrazole-3-carboxamide Traditional Name: 1-[(2-chloro-4-nitro-phenoxy)methyl]-N-(1-methylpyrazol-3-yl)pyrazole-3-carboxamide Formula: C15H13ClN6O4 MolecularWeight: 376.75452

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=CC(=N1)NC(=O)C2=NN(C=C2)COC3=C(C=C(C=C3)[N+](=O)[O-])Cl

Isomeric SMILES

CN1C=CC(=N1)NC(=O)C2=NN(C=C2)COC3=C(C=C(C=C3)[N+](=O)[O-])Cl

InChI

InChI=1S/C15H13ClN6O4/c1-20-6-5-14(19-20)17-15(23)12-4-7-21(18-12)9-26-13-3-2-10(22(24)25)8-11(13)16/h2-8H,9H2,1H3,(H,17,19,23)