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

Systemtic Name: 2-chloranyl-N,N-dimethyl-4-piperazin-4-ium-1-yl-benzamide Openeye Name: 2-chloro-N,N-dimethyl-4-piperazin-4-ium-1-yl-benzamide CAS Name: 2-chloro-N,N-dimethyl-4-(1-piperazin-4-iumyl)benzamide IUPAC Name: 2-chloro-N,N-dimethyl-4-piperazin-4-ium-1-ylbenzamide Traditional Name: 2-chloro-N,N-dimethyl-4-piperazin-4-ium-1-yl-benzamide Formula: C13H19ClN3O+ MolecularWeight: 268.76246

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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