2-azanyl-5-[(3,4-dimethoxyphenyl)methylidene]-4,6-dimethyl-cyclopenta[b]pyridin-1-ium-3,7-dicarbonitrile

Systemtic Name: 2-azanyl-5-[(3,4-dimethoxyphenyl)methylidene]-4,6-dimethyl-cyclopenta[b]pyridin-1-ium-3,7-dicarbonitrile Openeye Name: 2-amino-5-[(3,4-dimethoxyphenyl)methylene]-4,6-dimethyl-cyclopenta[b]pyridin-1-ium-3,7-dicarbonitrile CAS Name: 2-amino-5-[(3,4-dimethoxyphenyl)methylidene]-4,6-dimethylcyclopenta[b]pyridin-1-ium-3,7-dicarbonitrile IUPAC Name: 2-amino-5-[(3,4-dimethoxyphenyl)methylidene]-4,6-dimethylcyclopenta[b]pyridin-1-ium-3,7-dicarbonitrile Traditional Name: 2-amino-4,6-dimethyl-5-veratrylidene-1-pyrindin-1-ium-3,7-dicarbonitrile Formula: C21H19N4O2+ MolecularWeight: 359.40116

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C2=C(C1=CC3=CC(=C(C=C3)OC)OC)C(=C(C(=[NH+]2)N)C#N)C)C#N

Isomeric SMILES

CC1=C(C2=C(C1=CC3=CC(=C(C=C3)OC)OC)C(=C(C(=[NH+]2)N)C#N)C)C#N

InChI

InChI=1S/C21H18N4O2/c1-11-14(7-13-5-6-17(26-3)18(8-13)27-4)19-12(2)16(10-23)21(24)25-20(19)15(11)9-22/h5-8H,1-4H3,(H2,24,25)/p+1