(2R)-2-(4-chloranyl-2-methyl-phenoxy)-N-(4-methylpiperazin-4-ium-1-yl)propanamide

Systemtic Name: (2R)-2-(4-chloranyl-2-methyl-phenoxy)-N-(4-methylpiperazin-4-ium-1-yl)propanamide Openeye Name: (2R)-2-(4-chloro-2-methyl-phenoxy)-N-(4-methylpiperazin-4-ium-1-yl)propanamide CAS Name: (2R)-2-(4-chloro-2-methylphenoxy)-N-(4-methyl-1-piperazin-4-iumyl)propanamide IUPAC Name: (2R)-2-(4-chloro-2-methylphenoxy)-N-(4-methylpiperazin-4-ium-1-yl)propanamide Traditional Name: (2R)-2-(4-chloro-2-methyl-phenoxy)-N-(4-methylpiperazin-4-ium-1-yl)propionamide Formula: C15H23ClN3O2+ MolecularWeight: 312.81502

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)Cl)OC(C)C(=O)NN2CC[NH+](CC2)C

Isomeric SMILES

CC1=C(C=CC(=C1)Cl)O[C@H](C)C(=O)NN2CC[NH+](CC2)C

InChI

InChI=1S/C15H22ClN3O2/c1-11-10-13(16)4-5-14(11)21-12(2)15(20)17-19-8-6-18(3)7-9-19/h4-5,10,12H,6-9H2,1-3H3,(H,17,20)/p+1/t12-/m1/s1