3-[4-[(4-chlorophenyl)methyl]piperazin-1-ium-1-yl]-N-(5-methyl-1,2-oxazol-3-yl)propanamide

Systemtic Name: 3-[4-[(4-chlorophenyl)methyl]piperazin-1-ium-1-yl]-N-(5-methyl-1,2-oxazol-3-yl)propanamide Openeye Name: 3-[4-[(4-chlorophenyl)methyl]piperazin-1-ium-1-yl]-N-(5-methylisoxazol-3-yl)propanamide CAS Name: 3-[4-[(4-chlorophenyl)methyl]-1-piperazin-1-iumyl]-N-(5-methyl-3-isoxazolyl)propanamide IUPAC Name: 3-[4-[(4-chlorophenyl)methyl]piperazin-1-ium-1-yl]-N-(5-methyl-1,2-oxazol-3-yl)propanamide Traditional Name: 3-[4-(4-chlorobenzyl)piperazin-1-ium-1-yl]-N-(5-methylisoxazol-3-yl)propionamide Formula: C18H24ClN4O2+ MolecularWeight: 363.86176

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NO1)NC(=O)CC[NH+]2CCN(CC2)CC3=CC=C(C=C3)Cl

Isomeric SMILES

CC1=CC(=NO1)NC(=O)CC[NH+]2CCN(CC2)CC3=CC=C(C=C3)Cl

InChI

InChI=1S/C18H23ClN4O2/c1-14-12-17(21-25-14)20-18(24)6-7-22-8-10-23(11-9-22)13-15-2-4-16(19)5-3-15/h2-5,12H,6-11,13H2,1H3,(H,20,21,24)/p+1