2-(5-chloranyl-1-ethyl-3-nitro-6-oxidanylidene-pyridazin-4-yl)-2-quinolin-2-yl-ethanenitrile

Systemtic Name: 2-(5-chloranyl-1-ethyl-3-nitro-6-oxidanylidene-pyridazin-4-yl)-2-quinolin-2-yl-ethanenitrile Openeye Name: 2-(5-chloro-1-ethyl-3-nitro-6-oxo-pyridazin-4-yl)-2-(2-quinolyl)acetonitrile CAS Name: 2-(5-chloro-1-ethyl-3-nitro-6-oxo-4-pyridazinyl)-2-(2-quinolinyl)acetonitrile IUPAC Name: 2-(5-chloro-1-ethyl-3-nitro-6-oxopyridazin-4-yl)-2-quinolin-2-ylacetonitrile Traditional Name: 2-(5-chloro-1-ethyl-6-keto-3-nitro-pyridazin-4-yl)-2-(2-quinolyl)acetonitrile Formula: C17H12ClN5O3 MolecularWeight: 369.76188

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C(=O)C(=C(C(=N1)[N+](=O)[O-])C(C#N)C2=NC3=CC=CC=C3C=C2)Cl

Isomeric SMILES

CCN1C(=O)C(=C(C(=N1)[N+](=O)[O-])C(C#N)C2=NC3=CC=CC=C3C=C2)Cl

InChI

InChI=1S/C17H12ClN5O3/c1-2-22-17(24)15(18)14(16(21-22)23(25)26)11(9-19)13-8-7-10-5-3-4-6-12(10)20-13/h3-8,11H,2H2,1H3