N-[4-(1-methyl-6-oxidanylidene-pyridazin-3-yl)phenyl]-3,5-dinitro-benzamide

Systemtic Name: N-[4-(1-methyl-6-oxidanylidene-pyridazin-3-yl)phenyl]-3,5-dinitro-benzamide Openeye Name: N-[4-(1-methyl-6-oxo-pyridazin-3-yl)phenyl]-3,5-dinitro-benzamide CAS Name: N-[4-(1-methyl-6-oxo-3-pyridazinyl)phenyl]-3,5-dinitrobenzamide IUPAC Name: N-[4-(1-methyl-6-oxopyridazin-3-yl)phenyl]-3,5-dinitrobenzamide Traditional Name: N-[4-(6-keto-1-methyl-pyridazin-3-yl)phenyl]-3,5-dinitro-benzamide Formula: C18H13N5O6 MolecularWeight: 395.32572

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H13N5O6/c1-21-17(24)7-6-16(20-21)11-2-4-13(5-3-11)19-18(25)12-8-14(22(26)27)10-15(9-12)23(28)29/h2-10H,1H3,(H,19,25)