N-[2-(1-methylpiperidin-1-ium-1-yl)ethyl]-N-(phenylmethyl)cyclohexanamine

Systemtic Name: N-[2-(1-methylpiperidin-1-ium-1-yl)ethyl]-N-(phenylmethyl)cyclohexanamine Openeye Name: N-benzyl-N-[2-(1-methylpiperidin-1-ium-1-yl)ethyl]cyclohexanamine CAS Name: N-[2-(1-methyl-1-piperidin-1-iumyl)ethyl]-N-(phenylmethyl)cyclohexanamine IUPAC Name: N-benzyl-N-[2-(1-methylpiperidin-1-ium-1-yl)ethyl]cyclohexanamine Traditional Name: benzyl-cyclohexyl-[2-(1-methylpiperidin-1-ium-1-yl)ethyl]amine Formula: C21H35N2+ MolecularWeight: 315.516

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C[N+]1(CCCCC1)CCN(CC2=CC=CC=C2)C3CCCCC3

Isomeric SMILES

C[N+]1(CCCCC1)CCN(CC2=CC=CC=C2)C3CCCCC3

InChI

InChI=1S/C21H35N2/c1-23(16-9-4-10-17-23)18-15-22(21-13-7-3-8-14-21)19-20-11-5-2-6-12-20/h2,5-6,11-12,21H,3-4,7-10,13-19H2,1H3/q+1