2-[(2S)-4-(1,2-oxazol-3-ylmethyl)-1-(1-propan-2-ylpiperidin-4-yl)piperazin-1-ium-2-yl]ethanol

Systemtic Name: 2-[(2S)-4-(1,2-oxazol-3-ylmethyl)-1-(1-propan-2-ylpiperidin-4-yl)piperazin-1-ium-2-yl]ethanol Openeye Name: 2-[(2S)-1-(1-isopropyl-4-piperidyl)-4-(isoxazol-3-ylmethyl)piperazin-1-ium-2-yl]ethanol CAS Name: 2-[(2S)-4-(3-isoxazolylmethyl)-1-(1-propan-2-yl-4-piperidinyl)-2-piperazin-1-iumyl]ethanol IUPAC Name: 2-[(2S)-4-(1,2-oxazol-3-ylmethyl)-1-(1-propan-2-ylpiperidin-4-yl)piperazin-1-ium-2-yl]ethanol Traditional Name: 2-[(2S)-1-(1-isopropyl-4-piperidyl)-4-(isoxazol-3-ylmethyl)piperazin-1-ium-2-yl]ethanol Formula: C18H33N4O2+ MolecularWeight: 337.48022

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)N1CCC(CC1)[NH+]2CCN(CC2CCO)CC3=NOC=C3

Isomeric SMILES

CC(C)N1CCC(CC1)[NH+]2CCN(C[C@@H]2CCO)CC3=NOC=C3

InChI

InChI=1S/C18H32N4O2/c1-15(2)21-7-3-17(4-8-21)22-10-9-20(14-18(22)5-11-23)13-16-6-12-24-19-16/h6,12,15,17-18,23H,3-5,7-11,13-14H2,1-2H3/p+1/t18-/m0/s1