2-[4-(dimethylamino)pyridin-1-ium-1-yl]-N-propyl-ethanamide

Systemtic Name: 2-[4-(dimethylamino)pyridin-1-ium-1-yl]-N-propyl-ethanamide Openeye Name: 2-[4-(dimethylamino)pyridin-1-ium-1-yl]-N-propyl-acetamide CAS Name: 2-[4-(dimethylamino)-1-pyridin-1-iumyl]-N-propylacetamide IUPAC Name: 2-[4-(dimethylamino)pyridin-1-ium-1-yl]-N-propylacetamide Traditional Name: 2-[4-(dimethylamino)pyridin-1-ium-1-yl]-N-propyl-acetamide Formula: C12H20N3O+ MolecularWeight: 222.3067

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Descriptors Computed from Structure

Canonical SMILES:

CCCNC(=O)C[N+]1=CC=C(C=C1)N(C)C

Isomeric SMILES

CCCNC(=O)C[N+]1=CC=C(C=C1)N(C)C

InChI

InChI=1S/C12H19N3O/c1-4-7-13-12(16)10-15-8-5-11(6-9-15)14(2)3/h5-6,8-9H,4,7,10H2,1-3H3/p+1