1-[2-(4-chloranyl-2,6-dimethyl-phenoxy)ethyl]piperazine-1,4-diium

Systemtic Name: 1-[2-(4-chloranyl-2,6-dimethyl-phenoxy)ethyl]piperazine-1,4-diium Openeye Name: 1-[2-(4-chloro-2,6-dimethyl-phenoxy)ethyl]piperazine-1,4-diium CAS Name: 1-[2-(4-chloro-2,6-dimethylphenoxy)ethyl]piperazine-1,4-diium IUPAC Name: 1-[2-(4-chloro-2,6-dimethylphenoxy)ethyl]piperazine-1,4-diium Traditional Name: 1-[2-(4-chloro-2,6-dimethyl-phenoxy)ethyl]piperazine-1,4-diium Formula: C14H23ClN2O+2 MolecularWeight: 270.79822

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1OCC[NH+]2CC[NH2+]CC2)C)Cl

Isomeric SMILES

CC1=CC(=CC(=C1OCC[NH+]2CC[NH2+]CC2)C)Cl

InChI

InChI=1S/C14H21ClN2O/c1-11-9-13(15)10-12(2)14(11)18-8-7-17-5-3-16-4-6-17/h9-10,16H,3-8H2,1-2H3/p+2