2-azanyl-4-(3-ethoxy-4-oxidanyl-phenyl)-6-(4-methylphenyl)pyridin-1-ium-3-carbonitrile

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

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=CC(=C1)C2=CC(=[NH+]C(=C2C#N)N)C3=CC=C(C=C3)C)O

Isomeric SMILES

CCOC1=C(C=CC(=C1)C2=CC(=[NH+]C(=C2C#N)N)C3=CC=C(C=C3)C)O

InChI

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