2-(4-chloranylphenoxy)-1-[4-(4-phenylcyclohexyl)piperazin-4-ium-1-yl]ethanone

Systemtic Name: 2-(4-chloranylphenoxy)-1-[4-(4-phenylcyclohexyl)piperazin-4-ium-1-yl]ethanone Openeye Name: 2-(4-chlorophenoxy)-1-[4-(4-phenylcyclohexyl)piperazin-4-ium-1-yl]ethanone CAS Name: 2-(4-chlorophenoxy)-1-[4-(4-phenylcyclohexyl)-1-piperazin-4-iumyl]ethanone IUPAC Name: 2-(4-chlorophenoxy)-1-[4-(4-phenylcyclohexyl)piperazin-4-ium-1-yl]ethanone Traditional Name: 2-(4-chlorophenoxy)-1-[4-(4-phenylcyclohexyl)piperazin-4-ium-1-yl]ethanone Formula: C24H30ClN2O2+ MolecularWeight: 413.9602

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(CCC1C2=CC=CC=C2)[NH+]3CCN(CC3)C(=O)COC4=CC=C(C=C4)Cl

Isomeric SMILES

C1CC(CCC1C2=CC=CC=C2)[NH+]3CCN(CC3)C(=O)COC4=CC=C(C=C4)Cl

InChI

InChI=1S/C24H29ClN2O2/c25-21-8-12-23(13-9-21)29-18-24(28)27-16-14-26(15-17-27)22-10-6-20(7-11-22)19-4-2-1-3-5-19/h1-5,8-9,12-13,20,22H,6-7,10-11,14-18H2/p+1