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

Systemtic Name: 2-azanyl-5-[(3-chloranyl-5-ethoxy-4-propan-2-yloxy-phenyl)methylidene]-4,6-dimethyl-cyclopenta[b]pyridin-1-ium-3,7-dicarbonitrile Openeye Name: 2-amino-5-[(3-chloro-5-ethoxy-4-isopropoxy-phenyl)methylene]-4,6-dimethyl-cyclopenta[b]pyridin-1-ium-3,7-dicarbonitrile CAS Name: 2-amino-5-[(3-chloro-5-ethoxy-4-propan-2-yloxyphenyl)methylidene]-4,6-dimethylcyclopenta[b]pyridin-1-ium-3,7-dicarbonitrile IUPAC Name: 2-amino-5-[(3-chloro-5-ethoxy-4-propan-2-yloxyphenyl)methylidene]-4,6-dimethylcyclopenta[b]pyridin-1-ium-3,7-dicarbonitrile Traditional Name: 2-amino-5-(3-chloro-5-ethoxy-4-isopropoxy-benzylidene)-4,6-dimethyl-1-pyrindin-1-ium-3,7-dicarbonitrile Formula: C24H24ClN4O2+ MolecularWeight: 435.92596

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C24H23ClN4O2/c1-6-30-20-9-15(8-19(25)23(20)31-12(2)3)7-16-13(4)17(10-26)22-21(16)14(5)18(11-27)24(28)29-22/h7-9,12H,6H2,1-5H3,(H2,28,29)/p+1