3,3,8-trimethyl-6-(pentylamino)-1,4-dihydropyrano[3,4-c]pyridin-7-ium-5-carbonitrile

Systemtic Name: 3,3,8-trimethyl-6-(pentylamino)-1,4-dihydropyrano[3,4-c]pyridin-7-ium-5-carbonitrile Openeye Name: 3,3,8-trimethyl-6-(pentylamino)-1,4-dihydropyrano[3,4-c]pyridin-7-ium-5-carbonitrile CAS Name: 3,3,8-trimethyl-6-(pentylamino)-1,4-dihydropyrano[3,4-c]pyridin-7-ium-5-carbonitrile IUPAC Name: 3,3,8-trimethyl-6-(pentylamino)-1,4-dihydropyrano[3,4-c]pyridin-7-ium-5-carbonitrile Traditional Name: 6-(amylamino)-3,3,8-trimethyl-1,4-dihydropyrano[3,4-c]pyridin-7-ium-5-carbonitrile Formula: C17H26N3O+ MolecularWeight: 288.40784

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCNC1=[NH+]C(=C2COC(CC2=C1C#N)(C)C)C

Isomeric SMILES

CCCCCNC1=[NH+]C(=C2COC(CC2=C1C#N)(C)C)C

InChI

InChI=1S/C17H25N3O/c1-5-6-7-8-19-16-14(10-18)13-9-17(3,4)21-11-15(13)12(2)20-16/h5-9,11H2,1-4H3,(H,19,20)/p+1