4,5-dimethoxy-2-nitro-N-[3-(6-oxidanylidenepyridazin-1-yl)propyl]benzamide

Systemtic Name: 4,5-dimethoxy-2-nitro-N-[3-(6-oxidanylidenepyridazin-1-yl)propyl]benzamide Openeye Name: 4,5-dimethoxy-2-nitro-N-[3-(6-oxopyridazin-1-yl)propyl]benzamide CAS Name: 4,5-dimethoxy-2-nitro-N-[3-(6-oxo-1-pyridazinyl)propyl]benzamide IUPAC Name: 4,5-dimethoxy-2-nitro-N-[3-(6-oxopyridazin-1-yl)propyl]benzamide Traditional Name: N-[3-(6-ketopyridazin-1-yl)propyl]-4,5-dimethoxy-2-nitro-benzamide Formula: C16H18N4O6 MolecularWeight: 362.33732

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C(=C1)C(=O)NCCCN2C(=O)C=CC=N2)[N+](=O)[O-])OC

Isomeric SMILES

COC1=C(C=C(C(=C1)C(=O)NCCCN2C(=O)C=CC=N2)[N+](=O)[O-])OC

InChI

InChI=1S/C16H18N4O6/c1-25-13-9-11(12(20(23)24)10-14(13)26-2)16(22)17-6-4-8-19-15(21)5-3-7-18-19/h3,5,7,9-10H,4,6,8H2,1-2H3,(H,17,22)