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

Systemtic Name: 2-[(2S)-1-[(5-methylfuran-2-yl)methyl]-4-[(5-methylthiophen-2-yl)methyl]piperazin-1-ium-2-yl]ethanol Openeye Name: 2-[(2S)-1-[(5-methyl-2-furyl)methyl]-4-[(5-methyl-2-thienyl)methyl]piperazin-1-ium-2-yl]ethanol CAS Name: 2-[(2S)-1-[(5-methyl-2-furanyl)methyl]-4-[(5-methyl-2-thiophenyl)methyl]-2-piperazin-1-iumyl]ethanol IUPAC Name: 2-[(2S)-1-[(5-methylfuran-2-yl)methyl]-4-[(5-methylthiophen-2-yl)methyl]piperazin-1-ium-2-yl]ethanol Traditional Name: 2-[(2S)-1-[(5-methyl-2-furyl)methyl]-4-[(5-methyl-2-thienyl)methyl]piperazin-1-ium-2-yl]ethanol Formula: C18H27N2O2S+ MolecularWeight: 335.48418

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(O1)C[NH+]2CCN(CC2CCO)CC3=CC=C(S3)C

Isomeric SMILES

CC1=CC=C(O1)C[NH+]2CCN(C[C@@H]2CCO)CC3=CC=C(S3)C

InChI

InChI=1S/C18H26N2O2S/c1-14-3-5-17(22-14)12-20-9-8-19(11-16(20)7-10-21)13-18-6-4-15(2)23-18/h3-6,16,21H,7-13H2,1-2H3/p+1/t16-/m0/s1