1-[4-methoxy-3-[(4-propylpyridin-1-ium-1-yl)methyl]phenyl]ethanone

Systemtic Name: 1-[4-methoxy-3-[(4-propylpyridin-1-ium-1-yl)methyl]phenyl]ethanone Openeye Name: 1-[4-methoxy-3-[(4-propylpyridin-1-ium-1-yl)methyl]phenyl]ethanone CAS Name: 1-[4-methoxy-3-[(4-propyl-1-pyridin-1-iumyl)methyl]phenyl]ethanone IUPAC Name: 1-[4-methoxy-3-[(4-propylpyridin-1-ium-1-yl)methyl]phenyl]ethanone Traditional Name: 1-[4-methoxy-3-[(4-propylpyridin-1-ium-1-yl)methyl]phenyl]ethanone Formula: C18H22NO2+ MolecularWeight: 284.37278

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=CC=[N+](C=C1)CC2=C(C=CC(=C2)C(=O)C)OC

Isomeric SMILES

CCCC1=CC=[N+](C=C1)CC2=C(C=CC(=C2)C(=O)C)OC

InChI

InChI=1S/C18H22NO2/c1-4-5-15-8-10-19(11-9-15)13-17-12-16(14(2)20)6-7-18(17)21-3/h6-12H,4-5,13H2,1-3H3/q+1