(2S)-1-(4-methylpiperazine-1,4-diium-1-yl)-3-[(2S)-2-phenylpropoxy]propan-2-ol

Systemtic Name: (2S)-1-(4-methylpiperazine-1,4-diium-1-yl)-3-[(2S)-2-phenylpropoxy]propan-2-ol Openeye Name: (2S)-1-(4-methylpiperazine-1,4-diium-1-yl)-3-[(2S)-2-phenylpropoxy]propan-2-ol CAS Name: (2S)-1-(4-methyl-1-piperazine-1,4-diiumyl)-3-[(2S)-2-phenylpropoxy]-2-propanol IUPAC Name: (2S)-1-(4-methylpiperazine-1,4-diium-1-yl)-3-[(2S)-2-phenylpropoxy]propan-2-ol Traditional Name: (2S)-1-(4-methylpiperazine-1,4-diium-1-yl)-3-[(2S)-2-phenylpropoxy]propan-2-ol Formula: C17H30N2O2+2 MolecularWeight: 294.4323

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H28N2O2/c1-15(16-6-4-3-5-7-16)13-21-14-17(20)12-19-10-8-18(2)9-11-19/h3-7,15,17,20H,8-14H2,1-2H3/p+2/t15-,17+/m1/s1