2-[(2S)-4-[(3-ethyl-1H-imidazol-3-ium-2-yl)methyl]-1-(3-methylbutyl)piperazin-2-yl]ethanol

Systemtic Name: 2-[(2S)-4-[(3-ethyl-1H-imidazol-3-ium-2-yl)methyl]-1-(3-methylbutyl)piperazin-2-yl]ethanol Openeye Name: 2-[(2S)-4-[(3-ethyl-1H-imidazol-3-ium-2-yl)methyl]-1-isopentyl-piperazin-2-yl]ethanol CAS Name: 2-[(2S)-4-[(3-ethyl-1H-imidazol-3-ium-2-yl)methyl]-1-(3-methylbutyl)-2-piperazinyl]ethanol IUPAC Name: 2-[(2S)-4-[(3-ethyl-1H-imidazol-3-ium-2-yl)methyl]-1-(3-methylbutyl)piperazin-2-yl]ethanol Traditional Name: 2-[(2S)-4-[(3-ethyl-1H-imidazol-3-ium-2-yl)methyl]-1-isoamyl-piperazin-2-yl]ethanol Formula: C17H33N4O+ MolecularWeight: 309.47012

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Descriptors Computed from Structure

Canonical SMILES:

CC[N+]1=C(NC=C1)CN2CCN(C(C2)CCO)CCC(C)C

Isomeric SMILES

CC[N+]1=C(NC=C1)CN2CCN([C@H](C2)CCO)CCC(C)C

InChI

InChI=1S/C17H32N4O/c1-4-20-9-7-18-17(20)14-19-10-11-21(8-5-15(2)3)16(13-19)6-12-22/h7,9,15-16,22H,4-6,8,10-14H2,1-3H3/p+1/t16-/m0/s1