1-[4-oxidanyl-1-(phenylmethyl)-1,2,3,6-tetrahydropyridin-1-ium-5-yl]ethanone

Systemtic Name: 1-[4-oxidanyl-1-(phenylmethyl)-1,2,3,6-tetrahydropyridin-1-ium-5-yl]ethanone Openeye Name: 1-(1-benzyl-4-hydroxy-1,2,3,6-tetrahydropyridin-1-ium-5-yl)ethanone CAS Name: 1-[4-hydroxy-1-(phenylmethyl)-1,2,3,6-tetrahydropyridin-1-ium-5-yl]ethanone IUPAC Name: 1-(1-benzyl-4-hydroxy-1,2,3,6-tetrahydropyridin-1-ium-5-yl)ethanone Traditional Name: 1-(1-benzyl-4-hydroxy-1,2,3,6-tetrahydropyridin-1-ium-5-yl)ethanone Formula: C14H18NO2+ MolecularWeight: 232.29822

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C1=C(CC[NH+](C1)CC2=CC=CC=C2)O

Isomeric SMILES

CC(=O)C1=C(CC[NH+](C1)CC2=CC=CC=C2)O

InChI

InChI=1S/C14H17NO2/c1-11(16)13-10-15(8-7-14(13)17)9-12-5-3-2-4-6-12/h2-6,17H,7-10H2,1H3/p+1