5,6-dimethyl-3-oxidanylidene-2-(1,2,3,4-tetrahydroisoquinolin-2-ium-2-ylmethyl)pyridazine-4-carbonitrile

Systemtic Name: 5,6-dimethyl-3-oxidanylidene-2-(1,2,3,4-tetrahydroisoquinolin-2-ium-2-ylmethyl)pyridazine-4-carbonitrile Openeye Name: 5,6-dimethyl-3-oxo-2-(1,2,3,4-tetrahydroisoquinolin-2-ium-2-ylmethyl)pyridazine-4-carbonitrile CAS Name: 5,6-dimethyl-3-oxo-2-(1,2,3,4-tetrahydroisoquinolin-2-ium-2-ylmethyl)-4-pyridazinecarbonitrile IUPAC Name: 5,6-dimethyl-3-oxo-2-(1,2,3,4-tetrahydroisoquinolin-2-ium-2-ylmethyl)pyridazine-4-carbonitrile Traditional Name: 3-keto-5,6-dimethyl-2-(1,2,3,4-tetrahydroisoquinolin-2-ium-2-ylmethyl)pyridazine-4-carbonitrile Formula: C17H19N4O+ MolecularWeight: 295.35896

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=O)N(N=C1C)C[NH+]2CCC3=CC=CC=C3C2)C#N

Isomeric SMILES

CC1=C(C(=O)N(N=C1C)C[NH+]2CCC3=CC=CC=C3C2)C#N

InChI

InChI=1S/C17H18N4O/c1-12-13(2)19-21(17(22)16(12)9-18)11-20-8-7-14-5-3-4-6-15(14)10-20/h3-6H,7-8,10-11H2,1-2H3/p+1