2-[(2S)-1-cyclopentyl-4-(pyridin-2-ylmethyl)piperazin-1-ium-2-yl]ethanol

Systemtic Name: 2-[(2S)-1-cyclopentyl-4-(pyridin-2-ylmethyl)piperazin-1-ium-2-yl]ethanol Openeye Name: 2-[(2S)-1-cyclopentyl-4-(2-pyridylmethyl)piperazin-1-ium-2-yl]ethanol CAS Name: 2-[(2S)-1-cyclopentyl-4-(2-pyridinylmethyl)-2-piperazin-1-iumyl]ethanol IUPAC Name: 2-[(2S)-1-cyclopentyl-4-(pyridin-2-ylmethyl)piperazin-1-ium-2-yl]ethanol Traditional Name: 2-[(2S)-1-cyclopentyl-4-(2-pyridylmethyl)piperazin-1-ium-2-yl]ethanol Formula: C17H28N3O+ MolecularWeight: 290.42372

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(C1)[NH+]2CCN(CC2CCO)CC3=CC=CC=N3

Isomeric SMILES

C1CCC(C1)[NH+]2CCN(C[C@@H]2CCO)CC3=CC=CC=N3

InChI

InChI=1S/C17H27N3O/c21-12-8-17-14-19(13-15-5-3-4-9-18-15)10-11-20(17)16-6-1-2-7-16/h3-5,9,16-17,21H,1-2,6-8,10-14H2/p+1/t17-/m0/s1