N-methyl-N-[(3-phenyl-1,2,4-oxadiazol-5-yl)methyl]-2-piperidin-1-ium-1-yl-ethanamine

Systemtic Name: N-methyl-N-[(3-phenyl-1,2,4-oxadiazol-5-yl)methyl]-2-piperidin-1-ium-1-yl-ethanamine Openeye Name: N-methyl-N-[(3-phenyl-1,2,4-oxadiazol-5-yl)methyl]-2-piperidin-1-ium-1-yl-ethanamine CAS Name: N-methyl-N-[(3-phenyl-1,2,4-oxadiazol-5-yl)methyl]-2-(1-piperidin-1-iumyl)ethanamine IUPAC Name: N-methyl-N-[(3-phenyl-1,2,4-oxadiazol-5-yl)methyl]-2-piperidin-1-ium-1-ylethanamine Traditional Name: methyl-[(3-phenyl-1,2,4-oxadiazol-5-yl)methyl]-(2-piperidin-1-ium-1-ylethyl)amine Formula: C17H25N4O+ MolecularWeight: 301.4066

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CN(CC[NH+]1CCCCC1)CC2=NC(=NO2)C3=CC=CC=C3

Isomeric SMILES

CN(CC[NH+]1CCCCC1)CC2=NC(=NO2)C3=CC=CC=C3

InChI

InChI=1S/C17H24N4O/c1-20(12-13-21-10-6-3-7-11-21)14-16-18-17(19-22-16)15-8-4-2-5-9-15/h2,4-5,8-9H,3,6-7,10-14H2,1H3/p+1