8-ethyl-3,3-dimethyl-6-(3-methylbutylamino)-1,4-dihydropyrano[3,4-c]pyridin-7-ium-5-carbonitrile

Systemtic Name: 8-ethyl-3,3-dimethyl-6-(3-methylbutylamino)-1,4-dihydropyrano[3,4-c]pyridin-7-ium-5-carbonitrile Openeye Name: 8-ethyl-6-(isopentylamino)-3,3-dimethyl-1,4-dihydropyrano[3,4-c]pyridin-7-ium-5-carbonitrile CAS Name: 8-ethyl-3,3-dimethyl-6-(3-methylbutylamino)-1,4-dihydropyrano[3,4-c]pyridin-7-ium-5-carbonitrile IUPAC Name: 8-ethyl-3,3-dimethyl-6-(3-methylbutylamino)-1,4-dihydropyrano[3,4-c]pyridin-7-ium-5-carbonitrile Traditional Name: 8-ethyl-6-(isoamylamino)-3,3-dimethyl-1,4-dihydropyrano[3,4-c]pyridin-7-ium-5-carbonitrile Formula: C18H28N3O+ MolecularWeight: 302.43442

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C2COC(CC2=C(C(=[NH+]1)NCCC(C)C)C#N)(C)C

Isomeric SMILES

CCC1=C2COC(CC2=C(C(=[NH+]1)NCCC(C)C)C#N)(C)C

InChI

InChI=1S/C18H27N3O/c1-6-16-15-11-22-18(4,5)9-13(15)14(10-19)17(21-16)20-8-7-12(2)3/h12H,6-9,11H2,1-5H3,(H,20,21)/p+1