2-[4-(phenylmethyl)piperidin-1-ium-1-yl]-N-prop-2-ynyl-ethanamide

Systemtic Name: 2-[4-(phenylmethyl)piperidin-1-ium-1-yl]-N-prop-2-ynyl-ethanamide Openeye Name: 2-(4-benzylpiperidin-1-ium-1-yl)-N-prop-2-ynyl-acetamide CAS Name: 2-[4-(phenylmethyl)-1-piperidin-1-iumyl]-N-prop-2-ynylacetamide IUPAC Name: 2-(4-benzylpiperidin-1-ium-1-yl)-N-prop-2-ynylacetamide Traditional Name: 2-(4-benzylpiperidin-1-ium-1-yl)-N-propargyl-acetamide Formula: C17H23N2O+ MolecularWeight: 271.37732

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C#CCNC(=O)C[NH+]1CCC(CC1)CC2=CC=CC=C2

Isomeric SMILES

C#CCNC(=O)C[NH+]1CCC(CC1)CC2=CC=CC=C2

InChI

InChI=1S/C17H22N2O/c1-2-10-18-17(20)14-19-11-8-16(9-12-19)13-15-6-4-3-5-7-15/h1,3-7,16H,8-14H2,(H,18,20)/p+1