2-azanyl-4-(3,4-dimethoxyphenyl)-6-(4-methylphenyl)pyridin-1-ium-3-carbonitrile

Systemtic Name: 2-azanyl-4-(3,4-dimethoxyphenyl)-6-(4-methylphenyl)pyridin-1-ium-3-carbonitrile Openeye Name: 2-amino-4-(3,4-dimethoxyphenyl)-6-(p-tolyl)pyridin-1-ium-3-carbonitrile CAS Name: 2-amino-4-(3,4-dimethoxyphenyl)-6-(4-methylphenyl)-3-pyridin-1-iumcarbonitrile IUPAC Name: 2-amino-4-(3,4-dimethoxyphenyl)-6-(4-methylphenyl)pyridin-1-ium-3-carbonitrile Traditional Name: 2-amino-4-(3,4-dimethoxyphenyl)-6-(p-tolyl)pyridin-1-ium-3-carbonitrile Formula: C21H20N3O2+ MolecularWeight: 346.4024

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C2=[NH+]C(=C(C(=C2)C3=CC(=C(C=C3)OC)OC)C#N)N

Isomeric SMILES

CC1=CC=C(C=C1)C2=[NH+]C(=C(C(=C2)C3=CC(=C(C=C3)OC)OC)C#N)N

InChI

InChI=1S/C21H19N3O2/c1-13-4-6-14(7-5-13)18-11-16(17(12-22)21(23)24-18)15-8-9-19(25-2)20(10-15)26-3/h4-11H,1-3H3,(H2,23,24)/p+1