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

Systemtic Name: (5E)-2-azanyl-5-[(4-ethoxyphenyl)methylidene]-4,6-dimethyl-cyclopenta[b]pyridin-1-ium-3,7-dicarbonitrile Openeye Name: (5E)-2-amino-5-[(4-ethoxyphenyl)methylene]-4,6-dimethyl-cyclopenta[b]pyridin-1-ium-3,7-dicarbonitrile CAS Name: (5E)-2-amino-5-[(4-ethoxyphenyl)methylidene]-4,6-dimethylcyclopenta[b]pyridin-1-ium-3,7-dicarbonitrile IUPAC Name: (5E)-2-amino-5-[(4-ethoxyphenyl)methylidene]-4,6-dimethylcyclopenta[b]pyridin-1-ium-3,7-dicarbonitrile Traditional Name: (5E)-2-amino-5-(4-ethoxybenzylidene)-4,6-dimethyl-1-pyrindin-1-ium-3,7-dicarbonitrile Formula: C21H19N4O+ MolecularWeight: 343.40176

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)C=C2C(=C(C3=C2C(=C(C(=[NH+]3)N)C#N)C)C#N)C

Isomeric SMILES

CCOC1=CC=C(C=C1)/C=C/2\C(=C(C3=C2C(=C(C(=[NH+]3)N)C#N)C)C#N)C

InChI

InChI=1S/C21H18N4O/c1-4-26-15-7-5-14(6-8-15)9-16-12(2)17(10-22)20-19(16)13(3)18(11-23)21(24)25-20/h5-9H,4H2,1-3H3,(H2,24,25)/p+1/b16-9+