2-[4-[(3,4-dichlorophenyl)methyl]piperazin-1-ium-1-yl]ethanamide

Systemtic Name: 2-[4-[(3,4-dichlorophenyl)methyl]piperazin-1-ium-1-yl]ethanamide Openeye Name: 2-[4-[(3,4-dichlorophenyl)methyl]piperazin-1-ium-1-yl]acetamide CAS Name: 2-[4-[(3,4-dichlorophenyl)methyl]-1-piperazin-1-iumyl]acetamide IUPAC Name: 2-[4-[(3,4-dichlorophenyl)methyl]piperazin-1-ium-1-yl]acetamide Traditional Name: 2-[4-(3,4-dichlorobenzyl)piperazin-1-ium-1-yl]acetamide Formula: C13H18Cl2N3O+ MolecularWeight: 303.20752

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC[NH+]1CC(=O)N)CC2=CC(=C(C=C2)Cl)Cl

Isomeric SMILES

C1CN(CC[NH+]1CC(=O)N)CC2=CC(=C(C=C2)Cl)Cl

InChI

InChI=1S/C13H17Cl2N3O/c14-11-2-1-10(7-12(11)15)8-17-3-5-18(6-4-17)9-13(16)19/h1-2,7H,3-6,8-9H2,(H2,16,19)/p+1