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

Systemtic Name: 2-azanyl-5-[(2-chloranyl-5-nitro-phenyl)methylidene]-4,6-dimethyl-cyclopenta[b]pyridin-1-ium-3,7-dicarbonitrile Openeye Name: 2-amino-5-[(2-chloro-5-nitro-phenyl)methylene]-4,6-dimethyl-cyclopenta[b]pyridin-1-ium-3,7-dicarbonitrile CAS Name: 2-amino-5-[(2-chloro-5-nitrophenyl)methylidene]-4,6-dimethylcyclopenta[b]pyridin-1-ium-3,7-dicarbonitrile IUPAC Name: 2-amino-5-[(2-chloro-5-nitrophenyl)methylidene]-4,6-dimethylcyclopenta[b]pyridin-1-ium-3,7-dicarbonitrile Traditional Name: 2-amino-5-(2-chloro-5-nitro-benzylidene)-4,6-dimethyl-1-pyrindin-1-ium-3,7-dicarbonitrile Formula: C19H13ClN5O2+ MolecularWeight: 378.79182

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C2=C(C1=CC3=C(C=CC(=C3)[N+](=O)[O-])Cl)C(=C(C(=[NH+]2)N)C#N)C)C#N

Isomeric SMILES

CC1=C(C2=C(C1=CC3=C(C=CC(=C3)[N+](=O)[O-])Cl)C(=C(C(=[NH+]2)N)C#N)C)C#N

InChI

InChI=1S/C19H12ClN5O2/c1-9-13(6-11-5-12(25(26)27)3-4-16(11)20)17-10(2)15(8-22)19(23)24-18(17)14(9)7-21/h3-6H,1-2H3,(H2,23,24)/p+1