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

Systemtic Name: 2-[(2S)-4-[(3-ethyl-1H-imidazol-3-ium-2-yl)methyl]-1-(phenylmethyl)piperazin-2-yl]ethanol Openeye Name: 2-[(2S)-1-benzyl-4-[(3-ethyl-1H-imidazol-3-ium-2-yl)methyl]piperazin-2-yl]ethanol CAS Name: 2-[(2S)-4-[(3-ethyl-1H-imidazol-3-ium-2-yl)methyl]-1-(phenylmethyl)-2-piperazinyl]ethanol IUPAC Name: 2-[(2S)-1-benzyl-4-[(3-ethyl-1H-imidazol-3-ium-2-yl)methyl]piperazin-2-yl]ethanol Traditional Name: 2-[(2S)-1-benzyl-4-[(3-ethyl-1H-imidazol-3-ium-2-yl)methyl]piperazin-2-yl]ethanol Formula: C19H29N4O+ MolecularWeight: 329.45976

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Descriptors Computed from Structure

Canonical SMILES:

CC[N+]1=C(NC=C1)CN2CCN(C(C2)CCO)CC3=CC=CC=C3

Isomeric SMILES

CC[N+]1=C(NC=C1)CN2CCN([C@H](C2)CCO)CC3=CC=CC=C3

InChI

InChI=1S/C19H28N4O/c1-2-22-10-9-20-19(22)16-21-11-12-23(18(15-21)8-13-24)14-17-6-4-3-5-7-17/h3-7,9-10,18,24H,2,8,11-16H2,1H3/p+1/t18-/m0/s1