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

Systemtic Name: 3,3,8-trimethyl-6-(phenethylamino)-1,4-dihydropyrano[3,4-c]pyridin-7-ium-5-carbonitrile Openeye Name: 3,3,8-trimethyl-6-(phenethylamino)-1,4-dihydropyrano[3,4-c]pyridin-7-ium-5-carbonitrile CAS Name: 3,3,8-trimethyl-6-(phenethylamino)-1,4-dihydropyrano[3,4-c]pyridin-7-ium-5-carbonitrile IUPAC Name: 3,3,8-trimethyl-6-(phenethylamino)-1,4-dihydropyrano[3,4-c]pyridin-7-ium-5-carbonitrile Traditional Name: 3,3,8-trimethyl-6-(phenethylamino)-1,4-dihydropyrano[3,4-c]pyridin-7-ium-5-carbonitrile Formula: C20H24N3O+ MolecularWeight: 322.42406

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C2COC(CC2=C(C(=[NH+]1)NCCC3=CC=CC=C3)C#N)(C)C

Isomeric SMILES

CC1=C2COC(CC2=C(C(=[NH+]1)NCCC3=CC=CC=C3)C#N)(C)C

InChI

InChI=1S/C20H23N3O/c1-14-18-13-24-20(2,3)11-16(18)17(12-21)19(23-14)22-10-9-15-7-5-4-6-8-15/h4-8H,9-11,13H2,1-3H3,(H,22,23)/p+1