2-[(2S)-4-cyclooctyl-1-(1-propan-2-ylpiperidin-4-yl)piperazin-4-ium-2-yl]ethanol

Systemtic Name: 2-[(2S)-4-cyclooctyl-1-(1-propan-2-ylpiperidin-4-yl)piperazin-4-ium-2-yl]ethanol Openeye Name: 2-[(2S)-4-cyclooctyl-1-(1-isopropyl-4-piperidyl)piperazin-4-ium-2-yl]ethanol CAS Name: 2-[(2S)-4-cyclooctyl-1-(1-propan-2-yl-4-piperidinyl)-2-piperazin-4-iumyl]ethanol IUPAC Name: 2-[(2S)-4-cyclooctyl-1-(1-propan-2-ylpiperidin-4-yl)piperazin-4-ium-2-yl]ethanol Traditional Name: 2-[(2S)-4-cyclooctyl-1-(1-isopropyl-4-piperidyl)piperazin-4-ium-2-yl]ethanol Formula: C22H44N3O+ MolecularWeight: 366.60426

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)N1CCC(CC1)N2CC[NH+](CC2CCO)C3CCCCCCC3

Isomeric SMILES

CC(C)N1CCC(CC1)N2CC[NH+](C[C@@H]2CCO)C3CCCCCCC3

InChI

InChI=1S/C22H43N3O/c1-19(2)23-13-10-21(11-14-23)25-16-15-24(18-22(25)12-17-26)20-8-6-4-3-5-7-9-20/h19-22,26H,3-18H2,1-2H3/p+1/t22-/m0/s1