2-(4-chloranyl-2-methyl-phenoxy)-4-(dimethylamino)pyridin-1-ium-3-carbonitrile

Systemtic Name: 2-(4-chloranyl-2-methyl-phenoxy)-4-(dimethylamino)pyridin-1-ium-3-carbonitrile Openeye Name: 2-(4-chloro-2-methyl-phenoxy)-4-(dimethylamino)pyridin-1-ium-3-carbonitrile CAS Name: 2-(4-chloro-2-methylphenoxy)-4-(dimethylamino)-3-pyridin-1-iumcarbonitrile IUPAC Name: 2-(4-chloro-2-methylphenoxy)-4-(dimethylamino)pyridin-1-ium-3-carbonitrile Traditional Name: 2-(4-chloro-2-methyl-phenoxy)-4-(dimethylamino)pyridin-1-ium-3-carbonitrile Formula: C15H15ClN3O+ MolecularWeight: 288.7521

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)Cl)OC2=[NH+]C=CC(=C2C#N)N(C)C

Isomeric SMILES

CC1=C(C=CC(=C1)Cl)OC2=[NH+]C=CC(=C2C#N)N(C)C

InChI

InChI=1S/C15H14ClN3O/c1-10-8-11(16)4-5-14(10)20-15-12(9-17)13(19(2)3)6-7-18-15/h4-8H,1-3H3/p+1