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

Systemtic Name: 2-azanyl-5-[(5-chloranyl-2-ethoxy-phenyl)methylidene]-4,6-dimethyl-cyclopenta[b]pyridin-1-ium-3,7-dicarbonitrile Openeye Name: 2-amino-5-[(5-chloro-2-ethoxy-phenyl)methylene]-4,6-dimethyl-cyclopenta[b]pyridin-1-ium-3,7-dicarbonitrile CAS Name: 2-amino-5-[(5-chloro-2-ethoxyphenyl)methylidene]-4,6-dimethylcyclopenta[b]pyridin-1-ium-3,7-dicarbonitrile IUPAC Name: 2-amino-5-[(5-chloro-2-ethoxyphenyl)methylidene]-4,6-dimethylcyclopenta[b]pyridin-1-ium-3,7-dicarbonitrile Traditional Name: 2-amino-5-(5-chloro-2-ethoxy-benzylidene)-4,6-dimethyl-1-pyrindin-1-ium-3,7-dicarbonitrile Formula: C21H18ClN4O+ MolecularWeight: 377.84682

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H17ClN4O/c1-4-27-18-6-5-14(22)7-13(18)8-15-11(2)16(9-23)20-19(15)12(3)17(10-24)21(25)26-20/h5-8H,4H2,1-3H3,(H2,25,26)/p+1