N-[2-[6-(4-methylphenyl)pyridazin-3-yl]oxyethyl]-3,5-dinitro-benzamide

Systemtic Name: N-[2-[6-(4-methylphenyl)pyridazin-3-yl]oxyethyl]-3,5-dinitro-benzamide Openeye Name: 3,5-dinitro-N-[2-[6-(p-tolyl)pyridazin-3-yl]oxyethyl]benzamide CAS Name: N-[2-[[6-(4-methylphenyl)-3-pyridazinyl]oxy]ethyl]-3,5-dinitrobenzamide IUPAC Name: N-[2-[6-(4-methylphenyl)pyridazin-3-yl]oxyethyl]-3,5-dinitrobenzamide Traditional Name: 3,5-dinitro-N-[2-[6-(p-tolyl)pyridazin-3-yl]oxyethyl]benzamide Formula: C20H17N5O6 MolecularWeight: 423.37888

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C2=NN=C(C=C2)OCCNC(=O)C3=CC(=CC(=C3)[N+](=O)[O-])[N+](=O)[O-]

Isomeric SMILES

CC1=CC=C(C=C1)C2=NN=C(C=C2)OCCNC(=O)C3=CC(=CC(=C3)[N+](=O)[O-])[N+](=O)[O-]

InChI

InChI=1S/C20H17N5O6/c1-13-2-4-14(5-3-13)18-6-7-19(23-22-18)31-9-8-21-20(26)15-10-16(24(27)28)12-17(11-15)25(29)30/h2-7,10-12H,8-9H2,1H3,(H,21,26)