2-[(2S)-1-cyclohexyl-4-[(5-methylfuran-2-yl)methyl]piperazin-4-ium-2-yl]ethanol

Systemtic Name: 2-[(2S)-1-cyclohexyl-4-[(5-methylfuran-2-yl)methyl]piperazin-4-ium-2-yl]ethanol Openeye Name: 2-[(2S)-1-cyclohexyl-4-[(5-methyl-2-furyl)methyl]piperazin-4-ium-2-yl]ethanol CAS Name: 2-[(2S)-1-cyclohexyl-4-[(5-methyl-2-furanyl)methyl]-2-piperazin-4-iumyl]ethanol IUPAC Name: 2-[(2S)-1-cyclohexyl-4-[(5-methylfuran-2-yl)methyl]piperazin-4-ium-2-yl]ethanol Traditional Name: 2-[(2S)-1-cyclohexyl-4-[(5-methyl-2-furyl)methyl]piperazin-4-ium-2-yl]ethanol Formula: C18H31N2O2+ MolecularWeight: 307.45094

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(O1)C[NH+]2CCN(C(C2)CCO)C3CCCCC3

Isomeric SMILES

CC1=CC=C(O1)C[NH+]2CCN([C@H](C2)CCO)C3CCCCC3

InChI

InChI=1S/C18H30N2O2/c1-15-7-8-18(22-15)14-19-10-11-20(17(13-19)9-12-21)16-5-3-2-4-6-16/h7-8,16-17,21H,2-6,9-14H2,1H3/p+1/t17-/m0/s1