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

Systemtic Name: 2-azanyl-5-[(2-chloranyl-4,5-dimethoxy-phenyl)methylidene]-4,6-dimethyl-cyclopenta[b]pyridin-1-ium-3,7-dicarbonitrile Openeye Name: 2-amino-5-[(2-chloro-4,5-dimethoxy-phenyl)methylene]-4,6-dimethyl-cyclopenta[b]pyridin-1-ium-3,7-dicarbonitrile CAS Name: 2-amino-5-[(2-chloro-4,5-dimethoxyphenyl)methylidene]-4,6-dimethylcyclopenta[b]pyridin-1-ium-3,7-dicarbonitrile IUPAC Name: 2-amino-5-[(2-chloro-4,5-dimethoxyphenyl)methylidene]-4,6-dimethylcyclopenta[b]pyridin-1-ium-3,7-dicarbonitrile Traditional Name: 2-amino-5-(2-chloro-4,5-dimethoxy-benzylidene)-4,6-dimethyl-1-pyrindin-1-ium-3,7-dicarbonitrile Formula: C21H18ClN4O2+ MolecularWeight: 393.84622

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C2=C(C1=CC3=CC(=C(C=C3Cl)OC)OC)C(=C(C(=[NH+]2)N)C#N)C)C#N

Isomeric SMILES

CC1=C(C2=C(C1=CC3=CC(=C(C=C3Cl)OC)OC)C(=C(C(=[NH+]2)N)C#N)C)C#N

InChI

InChI=1S/C21H17ClN4O2/c1-10-13(5-12-6-17(27-3)18(28-4)7-16(12)22)19-11(2)15(9-24)21(25)26-20(19)14(10)8-23/h5-7H,1-4H3,(H2,25,26)/p+1