4-chloranyl-N,N-dimethyl-3-piperazin-4-ium-1-yl-benzamide

Systemtic Name: 4-chloranyl-N,N-dimethyl-3-piperazin-4-ium-1-yl-benzamide Openeye Name: 4-chloro-N,N-dimethyl-3-piperazin-4-ium-1-yl-benzamide CAS Name: 4-chloro-N,N-dimethyl-3-(1-piperazin-4-iumyl)benzamide IUPAC Name: 4-chloro-N,N-dimethyl-3-piperazin-4-ium-1-ylbenzamide Traditional Name: 4-chloro-N,N-dimethyl-3-piperazin-4-ium-1-yl-benzamide Formula: C13H19ClN3O+ MolecularWeight: 268.76246

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CN(C)C(=O)C1=CC(=C(C=C1)Cl)N2CC[NH2+]CC2

Isomeric SMILES

CN(C)C(=O)C1=CC(=C(C=C1)Cl)N2CC[NH2+]CC2

InChI

InChI=1S/C13H18ClN3O/c1-16(2)13(18)10-3-4-11(14)12(9-10)17-7-5-15-6-8-17/h3-4,9,15H,5-8H2,1-2H3/p+1