1-[1-(phenylmethyl)piperidin-1-ium-4-yl]butan-1-one

Systemtic Name: 1-[1-(phenylmethyl)piperidin-1-ium-4-yl]butan-1-one Openeye Name: 1-(1-benzylpiperidin-1-ium-4-yl)butan-1-one CAS Name: 1-[1-(phenylmethyl)-4-piperidin-1-iumyl]-1-butanone IUPAC Name: 1-(1-benzylpiperidin-1-ium-4-yl)butan-1-one Traditional Name: 1-(1-benzylpiperidin-1-ium-4-yl)butan-1-one Formula: C16H24NO+ MolecularWeight: 246.36786

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCC(=O)C1CC[NH+](CC1)CC2=CC=CC=C2

Isomeric SMILES

CCCC(=O)C1CC[NH+](CC1)CC2=CC=CC=C2

InChI

InChI=1S/C16H23NO/c1-2-6-16(18)15-9-11-17(12-10-15)13-14-7-4-3-5-8-14/h3-5,7-8,15H,2,6,9-13H2,1H3/p+1