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

Systemtic Name: 2-azanyl-5-[(3-methoxy-4-prop-2-ynoxy-phenyl)methylidene]-4,6-dimethyl-cyclopenta[b]pyridin-1-ium-3,7-dicarbonitrile Openeye Name: 2-amino-5-[(3-methoxy-4-prop-2-ynoxy-phenyl)methylene]-4,6-dimethyl-cyclopenta[b]pyridin-1-ium-3,7-dicarbonitrile CAS Name: 2-amino-5-[(3-methoxy-4-prop-2-ynoxyphenyl)methylidene]-4,6-dimethylcyclopenta[b]pyridin-1-ium-3,7-dicarbonitrile IUPAC Name: 2-amino-5-[(3-methoxy-4-prop-2-ynoxyphenyl)methylidene]-4,6-dimethylcyclopenta[b]pyridin-1-ium-3,7-dicarbonitrile Traditional Name: 2-amino-5-(3-methoxy-4-propargyloxy-benzylidene)-4,6-dimethyl-1-pyrindin-1-ium-3,7-dicarbonitrile Formula: C23H19N4O2+ MolecularWeight: 383.42256

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C23H18N4O2/c1-5-8-29-19-7-6-15(10-20(19)28-4)9-16-13(2)17(11-24)22-21(16)14(3)18(12-25)23(26)27-22/h1,6-7,9-10H,8H2,2-4H3,(H2,26,27)/p+1