1-[3-(4-chloranyl-2,6-dimethyl-phenoxy)propyl]piperazin-4-ium

Systemtic Name: 1-[3-(4-chloranyl-2,6-dimethyl-phenoxy)propyl]piperazin-4-ium Openeye Name: 1-[3-(4-chloro-2,6-dimethyl-phenoxy)propyl]piperazin-4-ium CAS Name: 1-[3-(4-chloro-2,6-dimethylphenoxy)propyl]piperazin-4-ium IUPAC Name: 1-[3-(4-chloro-2,6-dimethylphenoxy)propyl]piperazin-4-ium Traditional Name: 1-[3-(4-chloro-2,6-dimethyl-phenoxy)propyl]piperazin-4-ium Formula: C15H24ClN2O+ MolecularWeight: 283.81686

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1OCCCN2CC[NH2+]CC2)C)Cl

Isomeric SMILES

CC1=CC(=CC(=C1OCCCN2CC[NH2+]CC2)C)Cl

InChI

InChI=1S/C15H23ClN2O/c1-12-10-14(16)11-13(2)15(12)19-9-3-6-18-7-4-17-5-8-18/h10-11,17H,3-9H2,1-2H3/p+1