2-[(2S)-1-cyclopentyl-4-(3-pyrazol-1-ylpropyl)piperazin-1-ium-2-yl]ethanol

Systemtic Name: 2-[(2S)-1-cyclopentyl-4-(3-pyrazol-1-ylpropyl)piperazin-1-ium-2-yl]ethanol Openeye Name: 2-[(2S)-1-cyclopentyl-4-(3-pyrazol-1-ylpropyl)piperazin-1-ium-2-yl]ethanol CAS Name: 2-[(2S)-1-cyclopentyl-4-[3-(1-pyrazolyl)propyl]-2-piperazin-1-iumyl]ethanol IUPAC Name: 2-[(2S)-1-cyclopentyl-4-(3-pyrazol-1-ylpropyl)piperazin-1-ium-2-yl]ethanol Traditional Name: 2-[(2S)-1-cyclopentyl-4-(3-pyrazol-1-ylpropyl)piperazin-1-ium-2-yl]ethanol Formula: C17H31N4O+ MolecularWeight: 307.45424

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(C1)[NH+]2CCN(CC2CCO)CCCN3C=CC=N3

Isomeric SMILES

C1CCC(C1)[NH+]2CCN(C[C@@H]2CCO)CCCN3C=CC=N3

InChI

InChI=1S/C17H30N4O/c22-14-7-17-15-19(9-4-11-20-10-3-8-18-20)12-13-21(17)16-5-1-2-6-16/h3,8,10,16-17,22H,1-2,4-7,9,11-15H2/p+1/t17-/m0/s1