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

Systemtic Name: 8-ethyl-3,3-dimethyl-6-(phenethylamino)-1,4-dihydropyrano[3,4-c]pyridin-7-ium-5-carbonitrile Openeye Name: 8-ethyl-3,3-dimethyl-6-(phenethylamino)-1,4-dihydropyrano[3,4-c]pyridin-7-ium-5-carbonitrile CAS Name: 8-ethyl-3,3-dimethyl-6-(phenethylamino)-1,4-dihydropyrano[3,4-c]pyridin-7-ium-5-carbonitrile IUPAC Name: 8-ethyl-3,3-dimethyl-6-(phenethylamino)-1,4-dihydropyrano[3,4-c]pyridin-7-ium-5-carbonitrile Traditional Name: 8-ethyl-3,3-dimethyl-6-(phenethylamino)-1,4-dihydropyrano[3,4-c]pyridin-7-ium-5-carbonitrile Formula: C21H26N3O+ MolecularWeight: 336.45064

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C2COC(CC2=C(C(=[NH+]1)NCCC3=CC=CC=C3)C#N)(C)C

Isomeric SMILES

CCC1=C2COC(CC2=C(C(=[NH+]1)NCCC3=CC=CC=C3)C#N)(C)C

InChI

InChI=1S/C21H25N3O/c1-4-19-18-14-25-21(2,3)12-16(18)17(13-22)20(24-19)23-11-10-15-8-6-5-7-9-15/h5-9H,4,10-12,14H2,1-3H3,(H,23,24)/p+1