7,7-dimethyl-2-(3-oxidanylpropylamino)-5,8-dihydropyrano[4,3-b]pyridin-1-ium-3-carbonitrile

Systemtic Name: 7,7-dimethyl-2-(3-oxidanylpropylamino)-5,8-dihydropyrano[4,3-b]pyridin-1-ium-3-carbonitrile Openeye Name: 2-(3-hydroxypropylamino)-7,7-dimethyl-5,8-dihydropyrano[4,3-b]pyridin-1-ium-3-carbonitrile CAS Name: 2-(3-hydroxypropylamino)-7,7-dimethyl-5,8-dihydropyrano[4,3-b]pyridin-1-ium-3-carbonitrile IUPAC Name: 2-(3-hydroxypropylamino)-7,7-dimethyl-5,8-dihydropyrano[4,3-b]pyridin-1-ium-3-carbonitrile Traditional Name: 2-(3-hydroxypropylamino)-7,7-dimethyl-5,8-dihydropyrano[4,3-b]pyridin-1-ium-3-carbonitrile Formula: C14H20N3O2+ MolecularWeight: 262.3275

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Descriptors Computed from Structure

Canonical SMILES:

CC1(CC2=C(CO1)C=C(C(=[NH+]2)NCCCO)C#N)C

Isomeric SMILES

CC1(CC2=C(CO1)C=C(C(=[NH+]2)NCCCO)C#N)C

InChI

InChI=1S/C14H19N3O2/c1-14(2)7-12-11(9-19-14)6-10(8-15)13(17-12)16-4-3-5-18/h6,18H,3-5,7,9H2,1-2H3,(H,16,17)/p+1