3-methyl-1-(phenylmethyl)piperidin-1-ium-4-one

Systemtic Name: 3-methyl-1-(phenylmethyl)piperidin-1-ium-4-one Openeye Name: 1-benzyl-3-methyl-piperidin-1-ium-4-one CAS Name: 3-methyl-1-(phenylmethyl)-4-piperidin-1-iumone IUPAC Name: 1-benzyl-3-methylpiperidin-1-ium-4-one Traditional Name: 1-benzyl-3-methyl-piperidin-1-ium-4-one Formula: C13H18NO+ MolecularWeight: 204.28812

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1C[NH+](CCC1=O)CC2=CC=CC=C2

Isomeric SMILES

CC1C[NH+](CCC1=O)CC2=CC=CC=C2

InChI

InChI=1S/C13H17NO/c1-11-9-14(8-7-13(11)15)10-12-5-3-2-4-6-12/h2-6,11H,7-10H2,1H3/p+1