(2R)-1-[4-(5-chloranyl-2-methyl-phenyl)piperazin-1-ium-1-yl]-3-(4-propan-2-ylphenoxy)propan-2-ol

Systemtic Name: (2R)-1-[4-(5-chloranyl-2-methyl-phenyl)piperazin-1-ium-1-yl]-3-(4-propan-2-ylphenoxy)propan-2-ol Openeye Name: (2R)-1-[4-(5-chloro-2-methyl-phenyl)piperazin-1-ium-1-yl]-3-(4-isopropylphenoxy)propan-2-ol CAS Name: (2R)-1-[4-(5-chloro-2-methylphenyl)-1-piperazin-1-iumyl]-3-(4-propan-2-ylphenoxy)-2-propanol IUPAC Name: (2R)-1-[4-(5-chloro-2-methylphenyl)piperazin-1-ium-1-yl]-3-(4-propan-2-ylphenoxy)propan-2-ol Traditional Name: (2R)-1-[4-(5-chloro-2-methyl-phenyl)piperazin-1-ium-1-yl]-3-(4-isopropylphenoxy)propan-2-ol Formula: C23H32ClN2O2+ MolecularWeight: 403.96538

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C23H31ClN2O2/c1-17(2)19-5-8-22(9-6-19)28-16-21(27)15-25-10-12-26(13-11-25)23-14-20(24)7-4-18(23)3/h4-9,14,17,21,27H,10-13,15-16H2,1-3H3/p+1/t21-/m1/s1