1-[4-(2-bromanyl-4-chloranyl-6-methyl-phenoxy)butyl]-4-methyl-piperazine-1,4-diium

Systemtic Name: 1-[4-(2-bromanyl-4-chloranyl-6-methyl-phenoxy)butyl]-4-methyl-piperazine-1,4-diium Openeye Name: 1-[4-(2-bromo-4-chloro-6-methyl-phenoxy)butyl]-4-methyl-piperazine-1,4-diium CAS Name: 1-[4-(2-bromo-4-chloro-6-methylphenoxy)butyl]-4-methylpiperazine-1,4-diium IUPAC Name: 1-[4-(2-bromo-4-chloro-6-methylphenoxy)butyl]-4-methylpiperazine-1,4-diium Traditional Name: 1-[4-(2-bromo-4-chloro-6-methyl-phenoxy)butyl]-4-methyl-piperazine-1,4-diium Formula: C16H26BrClN2O+2 MolecularWeight: 377.74744

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1OCCCC[NH+]2CC[NH+](CC2)C)Br)Cl

Isomeric SMILES

CC1=CC(=CC(=C1OCCCC[NH+]2CC[NH+](CC2)C)Br)Cl

InChI

InChI=1S/C16H24BrClN2O/c1-13-11-14(18)12-15(17)16(13)21-10-4-3-5-20-8-6-19(2)7-9-20/h11-12H,3-10H2,1-2H3/p+2