2-[4-(5-cyano-3,3-dimethyl-8-phenyl-1,4-dihydropyrano[3,4-c]pyridin-7-ium-6-yl)piperazin-1-yl]-2-oxidanylidene-ethanamide

Systemtic Name: 2-[4-(5-cyano-3,3-dimethyl-8-phenyl-1,4-dihydropyrano[3,4-c]pyridin-7-ium-6-yl)piperazin-1-yl]-2-oxidanylidene-ethanamide Openeye Name: 2-[4-(5-cyano-3,3-dimethyl-8-phenyl-1,4-dihydropyrano[3,4-c]pyridin-7-ium-6-yl)piperazin-1-yl]-2-oxo-acetamide CAS Name: 2-[4-(5-cyano-3,3-dimethyl-8-phenyl-1,4-dihydropyrano[3,4-c]pyridin-7-ium-6-yl)-1-piperazinyl]-2-oxoacetamide IUPAC Name: 2-[4-(5-cyano-3,3-dimethyl-8-phenyl-1,4-dihydropyrano[3,4-c]pyridin-7-ium-6-yl)piperazin-1-yl]-2-oxoacetamide Traditional Name: 2-[4-(5-cyano-3,3-dimethyl-8-phenyl-1,4-dihydropyrano[3,4-c]pyridin-7-ium-6-yl)piperazino]-2-keto-acetamide Formula: C23H26N5O3+ MolecularWeight: 420.48424

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Descriptors Computed from Structure

Canonical SMILES:

CC1(CC2=C(C(=[NH+]C(=C2CO1)C3=CC=CC=C3)N4CCN(CC4)C(=O)C(=O)N)C#N)C

Isomeric SMILES

CC1(CC2=C(C(=[NH+]C(=C2CO1)C3=CC=CC=C3)N4CCN(CC4)C(=O)C(=O)N)C#N)C

InChI

InChI=1S/C23H25N5O3/c1-23(2)12-16-17(13-24)21(27-8-10-28(11-9-27)22(30)20(25)29)26-19(18(16)14-31-23)15-6-4-3-5-7-15/h3-7H,8-12,14H2,1-2H3,(H2,25,29)/p+1