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

Systemtic Name: 3,3,8-trimethyl-6-[(phenylmethyl)amino]-1,4-dihydropyrano[3,4-c]pyridin-7-ium-5-carbonitrile Openeye Name: 6-(benzylamino)-3,3,8-trimethyl-1,4-dihydropyrano[3,4-c]pyridin-7-ium-5-carbonitrile CAS Name: 3,3,8-trimethyl-6-[(phenylmethyl)amino]-1,4-dihydropyrano[3,4-c]pyridin-7-ium-5-carbonitrile IUPAC Name: 6-(benzylamino)-3,3,8-trimethyl-1,4-dihydropyrano[3,4-c]pyridin-7-ium-5-carbonitrile Traditional Name: 6-(benzylamino)-3,3,8-trimethyl-1,4-dihydropyrano[3,4-c]pyridin-7-ium-5-carbonitrile Formula: C19H22N3O+ MolecularWeight: 308.39748

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C2COC(CC2=C(C(=[NH+]1)NCC3=CC=CC=C3)C#N)(C)C

Isomeric SMILES

CC1=C2COC(CC2=C(C(=[NH+]1)NCC3=CC=CC=C3)C#N)(C)C

InChI

InChI=1S/C19H21N3O/c1-13-17-12-23-19(2,3)9-15(17)16(10-20)18(22-13)21-11-14-7-5-4-6-8-14/h4-8H,9,11-12H2,1-3H3,(H,21,22)/p+1