1-[6-(2-chloranyl-5-methyl-phenoxy)hexyl]-4-(2-methoxyphenyl)piperazin-1-ium

Systemtic Name: 1-[6-(2-chloranyl-5-methyl-phenoxy)hexyl]-4-(2-methoxyphenyl)piperazin-1-ium Openeye Name: 1-[6-(2-chloro-5-methyl-phenoxy)hexyl]-4-(2-methoxyphenyl)piperazin-1-ium CAS Name: 1-[6-(2-chloro-5-methylphenoxy)hexyl]-4-(2-methoxyphenyl)piperazin-1-ium IUPAC Name: 1-[6-(2-chloro-5-methylphenoxy)hexyl]-4-(2-methoxyphenyl)piperazin-1-ium Traditional Name: 1-[6-(2-chloro-5-methyl-phenoxy)hexyl]-4-(2-methoxyphenyl)piperazin-1-ium Formula: C24H34ClN2O2+ MolecularWeight: 417.99196

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)Cl)OCCCCCC[NH+]2CCN(CC2)C3=CC=CC=C3OC

Isomeric SMILES

CC1=CC(=C(C=C1)Cl)OCCCCCC[NH+]2CCN(CC2)C3=CC=CC=C3OC

InChI

InChI=1S/C24H33ClN2O2/c1-20-11-12-21(25)24(19-20)29-18-8-4-3-7-13-26-14-16-27(17-15-26)22-9-5-6-10-23(22)28-2/h5-6,9-12,19H,3-4,7-8,13-18H2,1-2H3/p+1