2-[5-chloranyl-1-(methoxymethyl)-6-oxidanylidene-pyridazin-4-yl]-2-quinolin-2-yl-ethanenitrile

Systemtic Name: 2-[5-chloranyl-1-(methoxymethyl)-6-oxidanylidene-pyridazin-4-yl]-2-quinolin-2-yl-ethanenitrile Openeye Name: 2-[5-chloro-1-(methoxymethyl)-6-oxo-pyridazin-4-yl]-2-(2-quinolyl)acetonitrile CAS Name: 2-[5-chloro-1-(methoxymethyl)-6-oxo-4-pyridazinyl]-2-(2-quinolinyl)acetonitrile IUPAC Name: 2-[5-chloro-1-(methoxymethyl)-6-oxopyridazin-4-yl]-2-quinolin-2-ylacetonitrile Traditional Name: 2-[5-chloro-6-keto-1-(methoxymethyl)pyridazin-4-yl]-2-(2-quinolyl)acetonitrile Formula: C17H13ClN4O2 MolecularWeight: 340.76372

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Descriptors Computed from Structure

Canonical SMILES:

COCN1C(=O)C(=C(C=N1)C(C#N)C2=NC3=CC=CC=C3C=C2)Cl

Isomeric SMILES

COCN1C(=O)C(=C(C=N1)C(C#N)C2=NC3=CC=CC=C3C=C2)Cl

InChI

InChI=1S/C17H13ClN4O2/c1-24-10-22-17(23)16(18)13(9-20-22)12(8-19)15-7-6-11-4-2-3-5-14(11)21-15/h2-7,9,12H,10H2,1H3