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

Systemtic Name: 3,3,8-trimethyl-6-[(phenylmethyl)amino]-1,4-dihydropyrano[3,4-c]pyridin-7-ium-5-carboxamide Openeye Name: 6-(benzylamino)-3,3,8-trimethyl-1,4-dihydropyrano[3,4-c]pyridin-7-ium-5-carboxamide CAS Name: 3,3,8-trimethyl-6-[(phenylmethyl)amino]-1,4-dihydropyrano[3,4-c]pyridin-7-ium-5-carboxamide IUPAC Name: 6-(benzylamino)-3,3,8-trimethyl-1,4-dihydropyrano[3,4-c]pyridin-7-ium-5-carboxamide Traditional Name: 6-(benzylamino)-3,3,8-trimethyl-1,4-dihydropyrano[3,4-c]pyridin-7-ium-5-carboxamide Formula: C19H24N3O2+ MolecularWeight: 326.41276

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C19H23N3O2/c1-12-15-11-24-19(2,3)9-14(15)16(17(20)23)18(22-12)21-10-13-7-5-4-6-8-13/h4-8H,9-11H2,1-3H3,(H2,20,23)(H,21,22)/p+1