2-[(3S)-3-methylpiperidin-1-ium-1-yl]-N-[[4-(morpholin-4-ium-4-ylmethyl)phenyl]methyl]ethanamide

Systemtic Name: 2-[(3S)-3-methylpiperidin-1-ium-1-yl]-N-[[4-(morpholin-4-ium-4-ylmethyl)phenyl]methyl]ethanamide Openeye Name: 2-[(3S)-3-methylpiperidin-1-ium-1-yl]-N-[[4-(morpholin-4-ium-4-ylmethyl)phenyl]methyl]acetamide CAS Name: 2-[(3S)-3-methyl-1-piperidin-1-iumyl]-N-[[4-(4-morpholin-4-iumylmethyl)phenyl]methyl]acetamide IUPAC Name: 2-[(3S)-3-methylpiperidin-1-ium-1-yl]-N-[[4-(morpholin-4-ium-4-ylmethyl)phenyl]methyl]acetamide Traditional Name: 2-[(3S)-3-methylpiperidin-1-ium-1-yl]-N-[4-(morpholin-4-ium-4-ylmethyl)benzyl]acetamide Formula: C20H33N3O2+2 MolecularWeight: 347.49492

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1CCC[NH+](C1)CC(=O)NCC2=CC=C(C=C2)C[NH+]3CCOCC3

Isomeric SMILES

C[C@H]1CCC[NH+](C1)CC(=O)NCC2=CC=C(C=C2)C[NH+]3CCOCC3

InChI

InChI=1S/C20H31N3O2/c1-17-3-2-8-23(14-17)16-20(24)21-13-18-4-6-19(7-5-18)15-22-9-11-25-12-10-22/h4-7,17H,2-3,8-16H2,1H3,(H,21,24)/p+2/t17-/m0/s1