(1S)-2-(4-methylpiperazine-1,4-diium-1-yl)-1-phenyl-ethanol

Systemtic Name: (1S)-2-(4-methylpiperazine-1,4-diium-1-yl)-1-phenyl-ethanol Openeye Name: (1S)-2-(4-methylpiperazine-1,4-diium-1-yl)-1-phenyl-ethanol CAS Name: (1S)-2-(4-methyl-1-piperazine-1,4-diiumyl)-1-phenylethanol IUPAC Name: (1S)-2-(4-methylpiperazine-1,4-diium-1-yl)-1-phenylethanol Traditional Name: (1S)-2-(4-methylpiperazine-1,4-diium-1-yl)-1-phenyl-ethanol Formula: C13H22N2O+2 MolecularWeight: 222.32658

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C13H20N2O/c1-14-7-9-15(10-8-14)11-13(16)12-5-3-2-4-6-12/h2-6,13,16H,7-11H2,1H3/p+2/t13-/m1/s1