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

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

Systemtic Name:2-azanyl-6-(3,4-dimethoxyphenyl)-4-(4-methoxyphenyl)pyridin-1-ium-3-carbonitrile
Openeye Name:2-amino-6-(3,4-dimethoxyphenyl)-4-(4-methoxyphenyl)pyridin-1-ium-3-carbonitrile
CAS Name:2-amino-6-(3,4-dimethoxyphenyl)-4-(4-methoxyphenyl)-3-pyridin-1-iumcarbonitrile
IUPAC Name:2-amino-6-(3,4-dimethoxyphenyl)-4-(4-methoxyphenyl)pyridin-1-ium-3-carbonitrile
Traditional Name:2-amino-6-(3,4-dimethoxyphenyl)-4-(4-methoxyphenyl)pyridin-1-ium-3-carbonitrile
Formula: C21H20N3O3+
MolecularWeight: 362.4018
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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C2=CC(=[NH+]C(=C2C#N)N)C3=CC(=C(C=C3)OC)OC


Isomeric SMILES

COC1=CC=C(C=C1)C2=CC(=[NH+]C(=C2C#N)N)C3=CC(=C(C=C3)OC)OC


InChI

InChI=1S/C21H19N3O3/c1-25-15-7-4-13(5-8-15)16-11-18(24-21(23)17(16)12-22)14-6-9-19(26-2)20(10-14)27-3/h4-11H,1-3H3,(H2,23,24)/p+1


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