2-[(2S)-1-cyclopentyl-4-(1H-pyrazol-5-ylmethyl)piperazin-1-ium-2-yl]ethanol

Systemtic Name: 2-[(2S)-1-cyclopentyl-4-(1H-pyrazol-5-ylmethyl)piperazin-1-ium-2-yl]ethanol Openeye Name: 2-[(2S)-1-cyclopentyl-4-(1H-pyrazol-5-ylmethyl)piperazin-1-ium-2-yl]ethanol CAS Name: 2-[(2S)-1-cyclopentyl-4-(1H-pyrazol-5-ylmethyl)-2-piperazin-1-iumyl]ethanol IUPAC Name: 2-[(2S)-1-cyclopentyl-4-(1H-pyrazol-5-ylmethyl)piperazin-1-ium-2-yl]ethanol Traditional Name: 2-[(2S)-1-cyclopentyl-4-(1H-pyrazol-5-ylmethyl)piperazin-1-ium-2-yl]ethanol Formula: C15H27N4O+ MolecularWeight: 279.40108

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(C1)[NH+]2CCN(CC2CCO)CC3=CC=NN3

Isomeric SMILES

C1CCC(C1)[NH+]2CCN(C[C@@H]2CCO)CC3=CC=NN3

InChI

InChI=1S/C15H26N4O/c20-10-6-15-12-18(11-13-5-7-16-17-13)8-9-19(15)14-3-1-2-4-14/h5,7,14-15,20H,1-4,6,8-12H2,(H,16,17)/p+1/t15-/m0/s1