2-[(2S)-4-[(5-cyclohexylthiophen-2-yl)methyl]-1-methyl-piperazin-1-ium-2-yl]ethanol

Systemtic Name: 2-[(2S)-4-[(5-cyclohexylthiophen-2-yl)methyl]-1-methyl-piperazin-1-ium-2-yl]ethanol Openeye Name: 2-[(2S)-4-[(5-cyclohexyl-2-thienyl)methyl]-1-methyl-piperazin-1-ium-2-yl]ethanol CAS Name: 2-[(2S)-4-[(5-cyclohexyl-2-thiophenyl)methyl]-1-methyl-2-piperazin-1-iumyl]ethanol IUPAC Name: 2-[(2S)-4-[(5-cyclohexylthiophen-2-yl)methyl]-1-methylpiperazin-1-ium-2-yl]ethanol Traditional Name: 2-[(2S)-4-[(5-cyclohexyl-2-thienyl)methyl]-1-methyl-piperazin-1-ium-2-yl]ethanol Formula: C18H31N2OS+ MolecularWeight: 323.51654

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+]1CCN(CC1CCO)CC2=CC=C(S2)C3CCCCC3

Isomeric SMILES

C[NH+]1CCN(C[C@@H]1CCO)CC2=CC=C(S2)C3CCCCC3

InChI

InChI=1S/C18H30N2OS/c1-19-10-11-20(13-16(19)9-12-21)14-17-7-8-18(22-17)15-5-3-2-4-6-15/h7-8,15-16,21H,2-6,9-14H2,1H3/p+1/t16-/m0/s1