2-azanyl-6-(2,5-dimethylphenyl)-4-(3-methoxyphenyl)pyridin-1-ium-3-carbonitrile

Systemtic Name: 2-azanyl-6-(2,5-dimethylphenyl)-4-(3-methoxyphenyl)pyridin-1-ium-3-carbonitrile Openeye Name: 2-amino-6-(2,5-dimethylphenyl)-4-(3-methoxyphenyl)pyridin-1-ium-3-carbonitrile CAS Name: 2-amino-6-(2,5-dimethylphenyl)-4-(3-methoxyphenyl)-3-pyridin-1-iumcarbonitrile IUPAC Name: 2-amino-6-(2,5-dimethylphenyl)-4-(3-methoxyphenyl)pyridin-1-ium-3-carbonitrile Traditional Name: 2-amino-6-(2,5-dimethylphenyl)-4-(3-methoxyphenyl)pyridin-1-ium-3-carbonitrile Formula: C21H20N3O+ MolecularWeight: 330.403

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H19N3O/c1-13-7-8-14(2)17(9-13)20-11-18(19(12-22)21(23)24-20)15-5-4-6-16(10-15)25-3/h4-11H,1-3H3,(H2,23,24)/p+1