3,5-dinitro-N-[3-(6-pyrrolidin-1-ylpyridazin-3-yl)phenyl]benzamide

Systemtic Name: 3,5-dinitro-N-[3-(6-pyrrolidin-1-ylpyridazin-3-yl)phenyl]benzamide Openeye Name: 3,5-dinitro-N-[3-(6-pyrrolidin-1-ylpyridazin-3-yl)phenyl]benzamide CAS Name: 3,5-dinitro-N-[3-[6-(1-pyrrolidinyl)-3-pyridazinyl]phenyl]benzamide IUPAC Name: 3,5-dinitro-N-[3-(6-pyrrolidin-1-ylpyridazin-3-yl)phenyl]benzamide Traditional Name: 3,5-dinitro-N-[3-(6-pyrrolidinopyridazin-3-yl)phenyl]benzamide Formula: C21H18N6O5 MolecularWeight: 434.40482

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)C2=NN=C(C=C2)C3=CC(=CC=C3)NC(=O)C4=CC(=CC(=C4)[N+](=O)[O-])[N+](=O)[O-]

Isomeric SMILES

C1CCN(C1)C2=NN=C(C=C2)C3=CC(=CC=C3)NC(=O)C4=CC(=CC(=C4)[N+](=O)[O-])[N+](=O)[O-]

InChI

InChI=1S/C21H18N6O5/c28-21(15-11-17(26(29)30)13-18(12-15)27(31)32)22-16-5-3-4-14(10-16)19-6-7-20(24-23-19)25-8-1-2-9-25/h3-7,10-13H,1-2,8-9H2,(H,22,28)