(2S)-1-[4-(4-aminophenyl)piperazin-1-ium-1-yl]propan-2-ol

Systemtic Name: (2S)-1-[4-(4-aminophenyl)piperazin-1-ium-1-yl]propan-2-ol Openeye Name: (2S)-1-[4-(4-aminophenyl)piperazin-1-ium-1-yl]propan-2-ol CAS Name: (2S)-1-[4-(4-aminophenyl)-1-piperazin-1-iumyl]-2-propanol IUPAC Name: (2S)-1-[4-(4-aminophenyl)piperazin-1-ium-1-yl]propan-2-ol Traditional Name: (2S)-1-[4-(4-aminophenyl)piperazin-1-ium-1-yl]propan-2-ol Formula: C13H22N3O+ MolecularWeight: 236.33328

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C13H21N3O/c1-11(17)10-15-6-8-16(9-7-15)13-4-2-12(14)3-5-13/h2-5,11,17H,6-10,14H2,1H3/p+1/t11-/m0/s1