(2R)-1-(4-chloranylphenoxy)-3-[4-(3-methylphenyl)piperazin-1-ium-1-yl]propan-2-ol

Systemtic Name: (2R)-1-(4-chloranylphenoxy)-3-[4-(3-methylphenyl)piperazin-1-ium-1-yl]propan-2-ol Openeye Name: (2R)-1-(4-chlorophenoxy)-3-[4-(m-tolyl)piperazin-1-ium-1-yl]propan-2-ol CAS Name: (2R)-1-(4-chlorophenoxy)-3-[4-(3-methylphenyl)-1-piperazin-1-iumyl]-2-propanol IUPAC Name: (2R)-1-(4-chlorophenoxy)-3-[4-(3-methylphenyl)piperazin-1-ium-1-yl]propan-2-ol Traditional Name: (2R)-1-(4-chlorophenoxy)-3-[4-(m-tolyl)piperazin-1-ium-1-yl]propan-2-ol Formula: C20H26ClN2O2+ MolecularWeight: 361.88564

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)N2CC[NH+](CC2)CC(COC3=CC=C(C=C3)Cl)O

Isomeric SMILES

CC1=CC(=CC=C1)N2CC[NH+](CC2)C[C@H](COC3=CC=C(C=C3)Cl)O

InChI

InChI=1S/C20H25ClN2O2/c1-16-3-2-4-18(13-16)23-11-9-22(10-12-23)14-19(24)15-25-20-7-5-17(21)6-8-20/h2-8,13,19,24H,9-12,14-15H2,1H3/p+1/t19-/m1/s1