1-[3-(2-bromanyl-6-chloranyl-4-methyl-phenoxy)propyl]-4-methyl-piperazin-4-ium

Systemtic Name: 1-[3-(2-bromanyl-6-chloranyl-4-methyl-phenoxy)propyl]-4-methyl-piperazin-4-ium Openeye Name: 1-[3-(2-bromo-6-chloro-4-methyl-phenoxy)propyl]-4-methyl-piperazin-4-ium CAS Name: 1-[3-(2-bromo-6-chloro-4-methylphenoxy)propyl]-4-methylpiperazin-4-ium IUPAC Name: 1-[3-(2-bromo-6-chloro-4-methylphenoxy)propyl]-4-methylpiperazin-4-ium Traditional Name: 1-[3-(2-bromo-6-chloro-4-methyl-phenoxy)propyl]-4-methyl-piperazin-4-ium Formula: C15H23BrClN2O+ MolecularWeight: 362.71292

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C(=C1)Br)OCCCN2CC[NH+](CC2)C)Cl

Isomeric SMILES

CC1=CC(=C(C(=C1)Br)OCCCN2CC[NH+](CC2)C)Cl

InChI

InChI=1S/C15H22BrClN2O/c1-12-10-13(16)15(14(17)11-12)20-9-3-4-19-7-5-18(2)6-8-19/h10-11H,3-9H2,1-2H3/p+1