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

Systemtic Name: 2-azanyl-4,6-dimethyl-5-[(2-methyl-4-piperidin-1-yl-phenyl)methylidene]cyclopenta[b]pyridin-1-ium-3,7-dicarbonitrile Openeye Name: 2-amino-4,6-dimethyl-5-[[2-methyl-4-(1-piperidyl)phenyl]methylene]cyclopenta[b]pyridin-1-ium-3,7-dicarbonitrile CAS Name: 2-amino-4,6-dimethyl-5-[[2-methyl-4-(1-piperidinyl)phenyl]methylidene]cyclopenta[b]pyridin-1-ium-3,7-dicarbonitrile IUPAC Name: 2-amino-4,6-dimethyl-5-[(2-methyl-4-piperidin-1-ylphenyl)methylidene]cyclopenta[b]pyridin-1-ium-3,7-dicarbonitrile Traditional Name: 2-amino-4,6-dimethyl-5-(2-methyl-4-piperidino-benzylidene)-1-pyrindin-1-ium-3,7-dicarbonitrile Formula: C25H26N5+ MolecularWeight: 396.50744

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)N2CCCCC2)C=C3C(=C(C4=C3C(=C(C(=[NH+]4)N)C#N)C)C#N)C

Isomeric SMILES

CC1=C(C=CC(=C1)N2CCCCC2)C=C3C(=C(C4=C3C(=C(C(=[NH+]4)N)C#N)C)C#N)C

InChI

InChI=1S/C25H25N5/c1-15-11-19(30-9-5-4-6-10-30)8-7-18(15)12-20-16(2)21(13-26)24-23(20)17(3)22(14-27)25(28)29-24/h7-8,11-12H,4-6,9-10H2,1-3H3,(H2,28,29)/p+1