2-[(2S)-4-[(5-ethylfuran-2-yl)methyl]-1-(3-methylbutyl)piperazin-4-ium-2-yl]ethanol

Systemtic Name: 2-[(2S)-4-[(5-ethylfuran-2-yl)methyl]-1-(3-methylbutyl)piperazin-4-ium-2-yl]ethanol Openeye Name: 2-[(2S)-4-[(5-ethyl-2-furyl)methyl]-1-isopentyl-piperazin-4-ium-2-yl]ethanol CAS Name: 2-[(2S)-4-[(5-ethyl-2-furanyl)methyl]-1-(3-methylbutyl)-2-piperazin-4-iumyl]ethanol IUPAC Name: 2-[(2S)-4-[(5-ethylfuran-2-yl)methyl]-1-(3-methylbutyl)piperazin-4-ium-2-yl]ethanol Traditional Name: 2-[(2S)-4-[(5-ethyl-2-furyl)methyl]-1-isoamyl-piperazin-4-ium-2-yl]ethanol Formula: C18H33N2O2+ MolecularWeight: 309.46682

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(O1)C[NH+]2CCN(C(C2)CCO)CCC(C)C

Isomeric SMILES

CCC1=CC=C(O1)C[NH+]2CCN([C@H](C2)CCO)CCC(C)C

InChI

InChI=1S/C18H32N2O2/c1-4-17-5-6-18(22-17)14-19-10-11-20(9-7-15(2)3)16(13-19)8-12-21/h5-6,15-16,21H,4,7-14H2,1-3H3/p+1/t16-/m0/s1