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

Systemtic Name: (2S)-1-[4-(phenylmethyl)piperazin-4-ium-1-yl]propan-2-ol Openeye Name: (2S)-1-(4-benzylpiperazin-4-ium-1-yl)propan-2-ol CAS Name: (2S)-1-[4-(phenylmethyl)-1-piperazin-4-iumyl]-2-propanol IUPAC Name: (2S)-1-(4-benzylpiperazin-4-ium-1-yl)propan-2-ol Traditional Name: (2S)-1-(4-benzylpiperazin-4-ium-1-yl)propan-2-ol Formula: C14H23N2O+ MolecularWeight: 235.34522

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Descriptors Computed from Structure

Canonical SMILES:

CC(CN1CC[NH+](CC1)CC2=CC=CC=C2)O

Isomeric SMILES

C[C@@H](CN1CC[NH+](CC1)CC2=CC=CC=C2)O

InChI

InChI=1S/C14H22N2O/c1-13(17)11-15-7-9-16(10-8-15)12-14-5-3-2-4-6-14/h2-6,13,17H,7-12H2,1H3/p+1/t13-/m0/s1