(2S)-1-(4-bromanylphenoxy)-3-[4-(5-chloranyl-2-methyl-phenyl)piperazin-1-yl]propan-2-ol

Systemtic Name: (2S)-1-(4-bromanylphenoxy)-3-[4-(5-chloranyl-2-methyl-phenyl)piperazin-1-yl]propan-2-ol Openeye Name: (2S)-1-(4-bromophenoxy)-3-[4-(5-chloro-2-methyl-phenyl)piperazin-1-yl]propan-2-ol CAS Name: (2S)-1-(4-bromophenoxy)-3-[4-(5-chloro-2-methylphenyl)-1-piperazinyl]-2-propanol IUPAC Name: (2S)-1-(4-bromophenoxy)-3-[4-(5-chloro-2-methylphenyl)piperazin-1-yl]propan-2-ol Traditional Name: (2S)-1-(4-bromophenoxy)-3-[4-(5-chloro-2-methyl-phenyl)piperazino]propan-2-ol Formula: C20H24BrClN2O2 MolecularWeight: 439.77376

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)Cl)N2CCN(CC2)CC(COC3=CC=C(C=C3)Br)O

Isomeric SMILES

CC1=C(C=C(C=C1)Cl)N2CCN(CC2)C[C@@H](COC3=CC=C(C=C3)Br)O

InChI

InChI=1S/C20H24BrClN2O2/c1-15-2-5-17(22)12-20(15)24-10-8-23(9-11-24)13-18(25)14-26-19-6-3-16(21)4-7-19/h2-7,12,18,25H,8-11,13-14H2,1H3/t18-/m0/s1