[(2R)-4-(phenylmethyl)piperazine-1,4-diium-2-yl]methanol

Systemtic Name: [(2R)-4-(phenylmethyl)piperazine-1,4-diium-2-yl]methanol Openeye Name: [(2R)-4-benzylpiperazine-1,4-diium-2-yl]methanol CAS Name: [(2R)-4-(phenylmethyl)-2-piperazine-1,4-diiumyl]methanol IUPAC Name: [(2R)-4-benzylpiperazine-1,4-diium-2-yl]methanol Traditional Name: [(2R)-4-benzylpiperazine-1,4-diium-2-yl]methanol Formula: C12H20N2O+2 MolecularWeight: 208.3

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Descriptors Computed from Structure

Canonical SMILES:

C1C[NH+](CC([NH2+]1)CO)CC2=CC=CC=C2

Isomeric SMILES

C1C[NH+](C[C@@H]([NH2+]1)CO)CC2=CC=CC=C2

InChI

InChI=1S/C12H18N2O/c15-10-12-9-14(7-6-13-12)8-11-4-2-1-3-5-11/h1-5,12-13,15H,6-10H2/p+2/t12-/m1/s1