(2S)-1-[4-(3-chlorophenyl)piperazin-1-ium-1-yl]-3-propan-2-yloxy-propan-2-ol

Systemtic Name: (2S)-1-[4-(3-chlorophenyl)piperazin-1-ium-1-yl]-3-propan-2-yloxy-propan-2-ol Openeye Name: (2S)-1-[4-(3-chlorophenyl)piperazin-1-ium-1-yl]-3-isopropoxy-propan-2-ol CAS Name: (2S)-1-[4-(3-chlorophenyl)-1-piperazin-1-iumyl]-3-propan-2-yloxy-2-propanol IUPAC Name: (2S)-1-[4-(3-chlorophenyl)piperazin-1-ium-1-yl]-3-propan-2-yloxypropan-2-ol Traditional Name: (2S)-1-[4-(3-chlorophenyl)piperazin-1-ium-1-yl]-3-isopropoxy-propan-2-ol Formula: C16H26ClN2O2+ MolecularWeight: 313.84284

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)OCC(C[NH+]1CCN(CC1)C2=CC(=CC=C2)Cl)O

Isomeric SMILES

CC(C)OC[C@H](C[NH+]1CCN(CC1)C2=CC(=CC=C2)Cl)O

InChI

InChI=1S/C16H25ClN2O2/c1-13(2)21-12-16(20)11-18-6-8-19(9-7-18)15-5-3-4-14(17)10-15/h3-5,10,13,16,20H,6-9,11-12H2,1-2H3/p+1/t16-/m0/s1