(E)-4-ethoxy-1-(4-methylpyridin-1-ium-1-yl)-4-oxidanyl-but-3-en-2-one

Systemtic Name: (E)-4-ethoxy-1-(4-methylpyridin-1-ium-1-yl)-4-oxidanyl-but-3-en-2-one Openeye Name: (E)-4-ethoxy-4-hydroxy-1-(4-methylpyridin-1-ium-1-yl)but-3-en-2-one CAS Name: (E)-4-ethoxy-4-hydroxy-1-(4-methyl-1-pyridin-1-iumyl)-3-buten-2-one IUPAC Name: (E)-4-ethoxy-4-hydroxy-1-(4-methylpyridin-1-ium-1-yl)but-3-en-2-one Traditional Name: (E)-4-ethoxy-4-hydroxy-1-(4-methylpyridin-1-ium-1-yl)but-3-en-2-one Formula: C12H16NO3+ MolecularWeight: 222.26034

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C12H15NO3/c1-3-16-12(15)8-11(14)9-13-6-4-10(2)5-7-13/h4-8H,3,9H2,1-2H3/p+1