2-[(2S)-4-[(1-ethyl-3,5-dimethyl-pyrazol-4-yl)methyl]-1-(3-methylbutyl)piperazin-1-ium-2-yl]ethanol

Systemtic Name: 2-[(2S)-4-[(1-ethyl-3,5-dimethyl-pyrazol-4-yl)methyl]-1-(3-methylbutyl)piperazin-1-ium-2-yl]ethanol Openeye Name: 2-[(2S)-4-[(1-ethyl-3,5-dimethyl-pyrazol-4-yl)methyl]-1-isopentyl-piperazin-1-ium-2-yl]ethanol CAS Name: 2-[(2S)-4-[(1-ethyl-3,5-dimethyl-4-pyrazolyl)methyl]-1-(3-methylbutyl)-2-piperazin-1-iumyl]ethanol IUPAC Name: 2-[(2S)-4-[(1-ethyl-3,5-dimethylpyrazol-4-yl)methyl]-1-(3-methylbutyl)piperazin-1-ium-2-yl]ethanol Traditional Name: 2-[(2S)-4-[(1-ethyl-3,5-dimethyl-pyrazol-4-yl)methyl]-1-isoamyl-piperazin-1-ium-2-yl]ethanol Formula: C19H37N4O+ MolecularWeight: 337.52328

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCN1C(=C(C(=N1)C)CN2CC[NH+](C(C2)CCO)CCC(C)C)C

Isomeric SMILES

CCN1C(=C(C(=N1)C)CN2CC[NH+]([C@H](C2)CCO)CCC(C)C)C

InChI

InChI=1S/C19H36N4O/c1-6-23-17(5)19(16(4)20-23)14-21-10-11-22(9-7-15(2)3)18(13-21)8-12-24/h15,18,24H,6-14H2,1-5H3/p+1/t18-/m0/s1