2-[(2S)-1-(furan-3-ylmethyl)-4-(2-methylpropyl)piperazin-4-ium-2-yl]ethanol

Systemtic Name: 2-[(2S)-1-(furan-3-ylmethyl)-4-(2-methylpropyl)piperazin-4-ium-2-yl]ethanol Openeye Name: 2-[(2S)-1-(3-furylmethyl)-4-isobutyl-piperazin-4-ium-2-yl]ethanol CAS Name: 2-[(2S)-1-(3-furanylmethyl)-4-(2-methylpropyl)-2-piperazin-4-iumyl]ethanol IUPAC Name: 2-[(2S)-1-(furan-3-ylmethyl)-4-(2-methylpropyl)piperazin-4-ium-2-yl]ethanol Traditional Name: 2-[(2S)-1-(3-furfuryl)-4-isobutyl-piperazin-4-ium-2-yl]ethanol Formula: C15H27N2O2+ MolecularWeight: 267.38708

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)C[NH+]1CCN(C(C1)CCO)CC2=COC=C2

Isomeric SMILES

CC(C)C[NH+]1CCN([C@H](C1)CCO)CC2=COC=C2

InChI

InChI=1S/C15H26N2O2/c1-13(2)9-16-5-6-17(15(11-16)3-7-18)10-14-4-8-19-12-14/h4,8,12-13,15,18H,3,5-7,9-11H2,1-2H3/p+1/t15-/m0/s1