4,6-dimethyl-2-(phenethylamino)pyridin-1-ium-3-carboxamide

Systemtic Name: 4,6-dimethyl-2-(phenethylamino)pyridin-1-ium-3-carboxamide Openeye Name: 4,6-dimethyl-2-(phenethylamino)pyridin-1-ium-3-carboxamide CAS Name: 4,6-dimethyl-2-(phenethylamino)-3-pyridin-1-iumcarboxamide IUPAC Name: 4,6-dimethyl-2-(phenethylamino)pyridin-1-ium-3-carboxamide Traditional Name: 4,6-dimethyl-2-(phenethylamino)pyridin-1-ium-3-carboxamide Formula: C16H20N3O+ MolecularWeight: 270.3495

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=[NH+]C(=C1C(=O)N)NCCC2=CC=CC=C2)C

Isomeric SMILES

CC1=CC(=[NH+]C(=C1C(=O)N)NCCC2=CC=CC=C2)C

InChI

InChI=1S/C16H19N3O/c1-11-10-12(2)19-16(14(11)15(17)20)18-9-8-13-6-4-3-5-7-13/h3-7,10H,8-9H2,1-2H3,(H2,17,20)(H,18,19)/p+1