N-[2-[2-(1,1-dimethylpiperidin-1-ium-2-yl)ethyl]phenyl]-4-methoxy-benzamide iodide

Systemtic Name: N-[2-[2-(1,1-dimethylpiperidin-1-ium-2-yl)ethyl]phenyl]-4-methoxy-benzamide iodide Openeye Name: N-[2-[2-(1,1-dimethylpiperidin-1-ium-2-yl)ethyl]phenyl]-4-methoxy-benzamide iodide CAS Name: N-[2-[2-(1,1-dimethyl-2-piperidin-1-iumyl)ethyl]phenyl]-4-methoxybenzamide iodide IUPAC Name: N-[2-[2-(1,1-dimethylpiperidin-1-ium-2-yl)ethyl]phenyl]-4-methoxybenzamide iodide Traditional Name: N-[2-[2-(1,1-dimethylpiperidin-1-ium-2-yl)ethyl]phenyl]-4-methoxy-benzamide iodide Formula: C23H31IN2O2 MolecularWeight: 494.40891

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C[N+]1(CCCCC1CCC2=CC=CC=C2NC(=O)C3=CC=C(C=C3)OC)C.[I-]

Isomeric SMILES

C[N+]1(CCCCC1CCC2=CC=CC=C2NC(=O)C3=CC=C(C=C3)OC)C.[I-]

InChI

InChI=1S/C23H30N2O2.HI/c1-25(2)17-7-6-9-20(25)14-11-18-8-4-5-10-22(18)24-23(26)19-12-15-21(27-3)16-13-19;/h4-5,8,10,12-13,15-16,20H,6-7,9,11,14,17H2,1-3H3;1H