2-[(2S)-4-[[5-(methoxymethyl)furan-2-yl]methyl]-1-propan-2-yl-piperazin-4-ium-2-yl]ethanol

Systemtic Name: 2-[(2S)-4-[[5-(methoxymethyl)furan-2-yl]methyl]-1-propan-2-yl-piperazin-4-ium-2-yl]ethanol Openeye Name: 2-[(2S)-1-isopropyl-4-[[5-(methoxymethyl)-2-furyl]methyl]piperazin-4-ium-2-yl]ethanol CAS Name: 2-[(2S)-4-[[5-(methoxymethyl)-2-furanyl]methyl]-1-propan-2-yl-2-piperazin-4-iumyl]ethanol IUPAC Name: 2-[(2S)-4-[[5-(methoxymethyl)furan-2-yl]methyl]-1-propan-2-ylpiperazin-4-ium-2-yl]ethanol Traditional Name: 2-[(2S)-1-isopropyl-4-[[5-(methoxymethyl)-2-furyl]methyl]piperazin-4-ium-2-yl]ethanol Formula: C16H29N2O3+ MolecularWeight: 297.41306

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)N1CC[NH+](CC1CCO)CC2=CC=C(O2)COC

Isomeric SMILES

CC(C)N1CC[NH+](C[C@@H]1CCO)CC2=CC=C(O2)COC

InChI

InChI=1S/C16H28N2O3/c1-13(2)18-8-7-17(10-14(18)6-9-19)11-15-4-5-16(21-15)12-20-3/h4-5,13-14,19H,6-12H2,1-3H3/p+1/t14-/m0/s1