(Z)-4-(1-methylpyridin-1-ium-4-yl)but-3-en-2-one

Systemtic Name: (Z)-4-(1-methylpyridin-1-ium-4-yl)but-3-en-2-one Openeye Name: (Z)-4-(1-methylpyridin-1-ium-4-yl)but-3-en-2-one CAS Name: (Z)-4-(1-methyl-4-pyridin-1-iumyl)-3-buten-2-one IUPAC Name: (Z)-4-(1-methylpyridin-1-ium-4-yl)but-3-en-2-one Traditional Name: (Z)-4-(1-methylpyridin-1-ium-4-yl)but-3-en-2-one Formula: C10H12NO+ MolecularWeight: 162.20838

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C=CC1=CC=[N+](C=C1)C

Isomeric SMILES

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

InChI

InChI=1S/C10H12NO/c1-9(12)3-4-10-5-7-11(2)8-6-10/h3-8H,1-2H3/q+1/b4-3-