2-(4-methoxyphenoxy)-1-[4-[(1R,2R)-2-methylcyclohexyl]piperazin-4-ium-1-yl]ethanone

Systemtic Name: 2-(4-methoxyphenoxy)-1-[4-[(1R,2R)-2-methylcyclohexyl]piperazin-4-ium-1-yl]ethanone Openeye Name: 2-(4-methoxyphenoxy)-1-[4-[(1R,2R)-2-methylcyclohexyl]piperazin-4-ium-1-yl]ethanone CAS Name: 2-(4-methoxyphenoxy)-1-[4-[(1R,2R)-2-methylcyclohexyl]-1-piperazin-4-iumyl]ethanone IUPAC Name: 2-(4-methoxyphenoxy)-1-[4-[(1R,2R)-2-methylcyclohexyl]piperazin-4-ium-1-yl]ethanone Traditional Name: 2-(4-methoxyphenoxy)-1-[4-[(1R,2R)-2-methylcyclohexyl]piperazin-4-ium-1-yl]ethanone Formula: C20H31N2O3+ MolecularWeight: 347.47174

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCCCC1[NH+]2CCN(CC2)C(=O)COC3=CC=C(C=C3)OC

Isomeric SMILES

C[C@@H]1CCCC[C@H]1[NH+]2CCN(CC2)C(=O)COC3=CC=C(C=C3)OC

InChI

InChI=1S/C20H30N2O3/c1-16-5-3-4-6-19(16)21-11-13-22(14-12-21)20(23)15-25-18-9-7-17(24-2)8-10-18/h7-10,16,19H,3-6,11-15H2,1-2H3/p+1/t16-,19-/m1/s1