(2R)-1-(4-cyclohexylphenoxy)-3-(4-phenylpiperazin-1-ium-1-yl)propan-2-ol

Systemtic Name: (2R)-1-(4-cyclohexylphenoxy)-3-(4-phenylpiperazin-1-ium-1-yl)propan-2-ol Openeye Name: (2R)-1-(4-cyclohexylphenoxy)-3-(4-phenylpiperazin-1-ium-1-yl)propan-2-ol CAS Name: (2R)-1-(4-cyclohexylphenoxy)-3-(4-phenyl-1-piperazin-1-iumyl)-2-propanol IUPAC Name: (2R)-1-(4-cyclohexylphenoxy)-3-(4-phenylpiperazin-1-ium-1-yl)propan-2-ol Traditional Name: (2R)-1-(4-cyclohexylphenoxy)-3-(4-phenylpiperazin-1-ium-1-yl)propan-2-ol Formula: C25H35N2O2+ MolecularWeight: 395.5576

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)C2=CC=C(C=C2)OCC(C[NH+]3CCN(CC3)C4=CC=CC=C4)O

Isomeric SMILES

C1CCC(CC1)C2=CC=C(C=C2)OC[C@@H](C[NH+]3CCN(CC3)C4=CC=CC=C4)O

InChI

InChI=1S/C25H34N2O2/c28-24(19-26-15-17-27(18-16-26)23-9-5-2-6-10-23)20-29-25-13-11-22(12-14-25)21-7-3-1-4-8-21/h2,5-6,9-14,21,24,28H,1,3-4,7-8,15-20H2/p+1/t24-/m1/s1