2-(4-bromanylphenoxy)-1-[4-(4-methylcyclohexyl)piperazin-4-ium-1-yl]ethanone

Systemtic Name: 2-(4-bromanylphenoxy)-1-[4-(4-methylcyclohexyl)piperazin-4-ium-1-yl]ethanone Openeye Name: 2-(4-bromophenoxy)-1-[4-(4-methylcyclohexyl)piperazin-4-ium-1-yl]ethanone CAS Name: 2-(4-bromophenoxy)-1-[4-(4-methylcyclohexyl)-1-piperazin-4-iumyl]ethanone IUPAC Name: 2-(4-bromophenoxy)-1-[4-(4-methylcyclohexyl)piperazin-4-ium-1-yl]ethanone Traditional Name: 2-(4-bromophenoxy)-1-[4-(4-methylcyclohexyl)piperazin-4-ium-1-yl]ethanone Formula: C19H28BrN2O2+ MolecularWeight: 396.34182

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCC(CC1)[NH+]2CCN(CC2)C(=O)COC3=CC=C(C=C3)Br

Isomeric SMILES

CC1CCC(CC1)[NH+]2CCN(CC2)C(=O)COC3=CC=C(C=C3)Br

InChI

InChI=1S/C19H27BrN2O2/c1-15-2-6-17(7-3-15)21-10-12-22(13-11-21)19(23)14-24-18-8-4-16(20)5-9-18/h4-5,8-9,15,17H,2-3,6-7,10-14H2,1H3/p+1