N-[(1-methylpiperidin-1-ium-4-yl)methyl]-N-phenethyl-cyclopentanecarboxamide

Systemtic Name: N-[(1-methylpiperidin-1-ium-4-yl)methyl]-N-phenethyl-cyclopentanecarboxamide Openeye Name: N-[(1-methylpiperidin-1-ium-4-yl)methyl]-N-phenethyl-cyclopentanecarboxamide CAS Name: N-[(1-methyl-4-piperidin-1-iumyl)methyl]-N-phenethylcyclopentanecarboxamide IUPAC Name: N-[(1-methylpiperidin-1-ium-4-yl)methyl]-N-phenethylcyclopentanecarboxamide Traditional Name: N-[(1-methylpiperidin-1-ium-4-yl)methyl]-N-phenethyl-cyclopentanecarboxamide Formula: C21H33N2O+ MolecularWeight: 329.49952

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C[NH+]1CCC(CC1)CN(CCC2=CC=CC=C2)C(=O)C3CCCC3

Isomeric SMILES

C[NH+]1CCC(CC1)CN(CCC2=CC=CC=C2)C(=O)C3CCCC3

InChI

InChI=1S/C21H32N2O/c1-22-14-11-19(12-15-22)17-23(21(24)20-9-5-6-10-20)16-13-18-7-3-2-4-8-18/h2-4,7-8,19-20H,5-6,9-17H2,1H3/p+1