2-azanyl-4-(3,4-dimethoxyphenyl)-6-ethoxy-pyridin-1-ium-3,5-dicarbonitrile

Systemtic Name: 2-azanyl-4-(3,4-dimethoxyphenyl)-6-ethoxy-pyridin-1-ium-3,5-dicarbonitrile Openeye Name: 2-amino-4-(3,4-dimethoxyphenyl)-6-ethoxy-pyridin-1-ium-3,5-dicarbonitrile CAS Name: 2-amino-4-(3,4-dimethoxyphenyl)-6-ethoxypyridin-1-ium-3,5-dicarbonitrile IUPAC Name: 2-amino-4-(3,4-dimethoxyphenyl)-6-ethoxypyridin-1-ium-3,5-dicarbonitrile Traditional Name: 2-amino-4-(3,4-dimethoxyphenyl)-6-ethoxy-pyridin-1-ium-3,5-dicarbonitrile Formula: C17H17N4O3+ MolecularWeight: 325.34188

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C(=C(C(=[NH+]1)N)C#N)C2=CC(=C(C=C2)OC)OC)C#N

Isomeric SMILES

CCOC1=C(C(=C(C(=[NH+]1)N)C#N)C2=CC(=C(C=C2)OC)OC)C#N

InChI

InChI=1S/C17H16N4O3/c1-4-24-17-12(9-19)15(11(8-18)16(20)21-17)10-5-6-13(22-2)14(7-10)23-3/h5-7H,4H2,1-3H3,(H2,20,21)/p+1