N-(3,4-dimethylphenyl)-2-[4-(2-hydroxyethyl)piperazin-4-ium-1-yl]ethanamide chloride

Systemtic Name: N-(3,4-dimethylphenyl)-2-[4-(2-hydroxyethyl)piperazin-4-ium-1-yl]ethanamide chloride Openeye Name: N-(3,4-dimethylphenyl)-2-[4-(2-hydroxyethyl)piperazin-4-ium-1-yl]acetamide chloride CAS Name: N-(3,4-dimethylphenyl)-2-[4-(2-hydroxyethyl)-1-piperazin-4-iumyl]acetamide chloride IUPAC Name: N-(3,4-dimethylphenyl)-2-[4-(2-hydroxyethyl)piperazin-4-ium-1-yl]acetamide chloride Traditional Name: N-(3,4-dimethylphenyl)-2-[4-(2-hydroxyethyl)piperazin-4-ium-1-yl]acetamide chloride Formula: C16H26ClN3O2 MolecularWeight: 327.84954

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)NC(=O)CN2CC[NH+](CC2)CCO)C.[Cl-]

Isomeric SMILES

CC1=C(C=C(C=C1)NC(=O)CN2CC[NH+](CC2)CCO)C.[Cl-]

InChI

InChI=1S/C16H25N3O2.ClH/c1-13-3-4-15(11-14(13)2)17-16(21)12-19-7-5-18(6-8-19)9-10-20;/h3-4,11,20H,5-10,12H2,1-2H3,(H,17,21);1H