2-[(2S)-1-(1-methylpiperidin-4-yl)-4-[(3-methylthiophen-2-yl)methyl]piperazin-1-ium-2-yl]ethanol

Systemtic Name: 2-[(2S)-1-(1-methylpiperidin-4-yl)-4-[(3-methylthiophen-2-yl)methyl]piperazin-1-ium-2-yl]ethanol Openeye Name: 2-[(2S)-1-(1-methyl-4-piperidyl)-4-[(3-methyl-2-thienyl)methyl]piperazin-1-ium-2-yl]ethanol CAS Name: 2-[(2S)-1-(1-methyl-4-piperidinyl)-4-[(3-methyl-2-thiophenyl)methyl]-2-piperazin-1-iumyl]ethanol IUPAC Name: 2-[(2S)-1-(1-methylpiperidin-4-yl)-4-[(3-methylthiophen-2-yl)methyl]piperazin-1-ium-2-yl]ethanol Traditional Name: 2-[(2S)-1-(1-methyl-4-piperidyl)-4-[(3-methyl-2-thienyl)methyl]piperazin-1-ium-2-yl]ethanol Formula: C18H32N3OS+ MolecularWeight: 338.53118

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC=C1)CN2CC[NH+](C(C2)CCO)C3CCN(CC3)C

Isomeric SMILES

CC1=C(SC=C1)CN2CC[NH+]([C@H](C2)CCO)C3CCN(CC3)C

InChI

InChI=1S/C18H31N3OS/c1-15-6-12-23-18(15)14-20-9-10-21(17(13-20)5-11-22)16-3-7-19(2)8-4-16/h6,12,16-17,22H,3-5,7-11,13-14H2,1-2H3/p+1/t17-/m0/s1