3-methoxy-4-nitro-N-(3-nitro-5-pyridin-3-yloxy-phenyl)-1H-pyrazole-5-carboxamide

Systemtic Name: 3-methoxy-4-nitro-N-(3-nitro-5-pyridin-3-yloxy-phenyl)-1H-pyrazole-5-carboxamide Openeye Name: 3-methoxy-4-nitro-N-[3-nitro-5-(3-pyridyloxy)phenyl]-1H-pyrazole-5-carboxamide CAS Name: 3-methoxy-4-nitro-N-[3-nitro-5-(3-pyridinyloxy)phenyl]-1H-pyrazole-5-carboxamide IUPAC Name: 3-methoxy-4-nitro-N-(3-nitro-5-pyridin-3-yloxyphenyl)-1H-pyrazole-5-carboxamide Traditional Name: 3-methoxy-4-nitro-N-[3-nitro-5-(3-pyridyloxy)phenyl]-1H-pyrazole-5-carboxamide Formula: C16H12N6O7 MolecularWeight: 400.30248

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Descriptors Computed from Structure

Canonical SMILES:

COC1=NNC(=C1[N+](=O)[O-])C(=O)NC2=CC(=CC(=C2)OC3=CN=CC=C3)[N+](=O)[O-]

Isomeric SMILES

COC1=NNC(=C1[N+](=O)[O-])C(=O)NC2=CC(=CC(=C2)OC3=CN=CC=C3)[N+](=O)[O-]

InChI

InChI=1S/C16H12N6O7/c1-28-16-14(22(26)27)13(19-20-16)15(23)18-9-5-10(21(24)25)7-12(6-9)29-11-3-2-4-17-8-11/h2-8H,1H3,(H,18,23)(H,19,20)