3-[4-(phenylmethyl)piperazin-1-ium-1-yl]propan-1-ol

Systemtic Name: 3-[4-(phenylmethyl)piperazin-1-ium-1-yl]propan-1-ol Openeye Name: 3-(4-benzylpiperazin-1-ium-1-yl)propan-1-ol CAS Name: 3-[4-(phenylmethyl)-1-piperazin-1-iumyl]-1-propanol IUPAC Name: 3-(4-benzylpiperazin-1-ium-1-yl)propan-1-ol Traditional Name: 3-(4-benzylpiperazin-1-ium-1-yl)propan-1-ol Formula: C14H23N2O+ MolecularWeight: 235.34522

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC[NH+]1CCCO)CC2=CC=CC=C2

Isomeric SMILES

C1CN(CC[NH+]1CCCO)CC2=CC=CC=C2

InChI

InChI=1S/C14H22N2O/c17-12-4-7-15-8-10-16(11-9-15)13-14-5-2-1-3-6-14/h1-3,5-6,17H,4,7-13H2/p+1