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

Systemtic Name: 2-[(2S)-4-[(1-ethylindol-3-yl)methyl]-1-[(5-methylfuran-2-yl)methyl]piperazin-1-ium-2-yl]ethanol Openeye Name: 2-[(2S)-4-[(1-ethylindol-3-yl)methyl]-1-[(5-methyl-2-furyl)methyl]piperazin-1-ium-2-yl]ethanol CAS Name: 2-[(2S)-4-[(1-ethyl-3-indolyl)methyl]-1-[(5-methyl-2-furanyl)methyl]-2-piperazin-1-iumyl]ethanol IUPAC Name: 2-[(2S)-4-[(1-ethylindol-3-yl)methyl]-1-[(5-methylfuran-2-yl)methyl]piperazin-1-ium-2-yl]ethanol Traditional Name: 2-[(2S)-4-[(1-ethylindol-3-yl)methyl]-1-[(5-methyl-2-furyl)methyl]piperazin-1-ium-2-yl]ethanol Formula: C23H32N3O2+ MolecularWeight: 382.51908

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCN1C=C(C2=CC=CC=C21)CN3CC[NH+](C(C3)CCO)CC4=CC=C(O4)C

Isomeric SMILES

CCN1C=C(C2=CC=CC=C21)CN3CC[NH+]([C@H](C3)CCO)CC4=CC=C(O4)C

InChI

InChI=1S/C23H31N3O2/c1-3-25-15-19(22-6-4-5-7-23(22)25)14-24-11-12-26(20(16-24)10-13-27)17-21-9-8-18(2)28-21/h4-9,15,20,27H,3,10-14,16-17H2,1-2H3/p+1/t20-/m0/s1