2-[4-(1H-imidazo[4,5-d]pyridazin-2-yl)-3-methoxy-phenoxy]ethanenitrile hydrochloride

Systemtic Name: 2-[4-(1H-imidazo[4,5-d]pyridazin-2-yl)-3-methoxy-phenoxy]ethanenitrile hydrochloride Openeye Name: 2-[4-(1H-imidazo[4,5-d]pyridazin-2-yl)-3-methoxy-phenoxy]acetonitrile hydrochloride CAS Name: 2-[4-(1H-imidazo[4,5-d]pyridazin-2-yl)-3-methoxyphenoxy]acetonitrile hydrochloride IUPAC Name: 2-[4-(1H-imidazo[4,5-d]pyridazin-2-yl)-3-methoxyphenoxy]acetonitrile hydrochloride Traditional Name: 2-[4-(1H-imidazo[4,5-d]pyridazin-2-yl)-3-methoxy-phenoxy]acetonitrile hydrochloride Formula: C14H12ClN5O2 MolecularWeight: 317.73038

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=CC(=C1)OCC#N)C2=NC3=CN=NC=C3N2.Cl

Isomeric SMILES

COC1=C(C=CC(=C1)OCC#N)C2=NC3=CN=NC=C3N2.Cl

InChI

InChI=1S/C14H11N5O2.ClH/c1-20-13-6-9(21-5-4-15)2-3-10(13)14-18-11-7-16-17-8-12(11)19-14;/h2-3,6-8H,5H2,1H3,(H,18,19);1H