2-azanyl-6-(4-methoxyphenyl)-4-(1H-pyrrol-2-yl)pyridin-1-ium-3-carbonitrile

Systemtic Name: 2-azanyl-6-(4-methoxyphenyl)-4-(1H-pyrrol-2-yl)pyridin-1-ium-3-carbonitrile Openeye Name: 2-amino-6-(4-methoxyphenyl)-4-(1H-pyrrol-2-yl)pyridin-1-ium-3-carbonitrile CAS Name: 2-amino-6-(4-methoxyphenyl)-4-(1H-pyrrol-2-yl)-3-pyridin-1-iumcarbonitrile IUPAC Name: 2-amino-6-(4-methoxyphenyl)-4-(1H-pyrrol-2-yl)pyridin-1-ium-3-carbonitrile Traditional Name: 2-amino-6-(4-methoxyphenyl)-4-(1H-pyrrol-2-yl)pyridin-1-ium-3-carbonitrile Formula: C17H15N4O+ MolecularWeight: 291.3272

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C2=[NH+]C(=C(C(=C2)C3=CC=CN3)C#N)N

Isomeric SMILES

COC1=CC=C(C=C1)C2=[NH+]C(=C(C(=C2)C3=CC=CN3)C#N)N

InChI

InChI=1S/C17H14N4O/c1-22-12-6-4-11(5-7-12)16-9-13(15-3-2-8-20-15)14(10-18)17(19)21-16/h2-9,20H,1H3,(H2,19,21)/p+1