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

Systemtic Name: 2-(4-methylphenoxy)-1-[4-(4-phenylcyclohexyl)piperazin-4-ium-1-yl]ethanone Openeye Name: 2-(4-methylphenoxy)-1-[4-(4-phenylcyclohexyl)piperazin-4-ium-1-yl]ethanone CAS Name: 2-(4-methylphenoxy)-1-[4-(4-phenylcyclohexyl)-1-piperazin-4-iumyl]ethanone IUPAC Name: 2-(4-methylphenoxy)-1-[4-(4-phenylcyclohexyl)piperazin-4-ium-1-yl]ethanone Traditional Name: 2-(4-methylphenoxy)-1-[4-(4-phenylcyclohexyl)piperazin-4-ium-1-yl]ethanone Formula: C25H33N2O2+ MolecularWeight: 393.54172

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)OCC(=O)N2CC[NH+](CC2)C3CCC(CC3)C4=CC=CC=C4

Isomeric SMILES

CC1=CC=C(C=C1)OCC(=O)N2CC[NH+](CC2)C3CCC(CC3)C4=CC=CC=C4

InChI

InChI=1S/C25H32N2O2/c1-20-7-13-24(14-8-20)29-19-25(28)27-17-15-26(16-18-27)23-11-9-22(10-12-23)21-5-3-2-4-6-21/h2-8,13-14,22-23H,9-12,15-19H2,1H3/p+1