2-[2-[4-methyl-1,5-bis(oxidanyl)pentan-2-yl]-1,3-thiazolidin-3-ium-3-yl]-1-phenyl-ethanone

Systemtic Name: 2-[2-[4-methyl-1,5-bis(oxidanyl)pentan-2-yl]-1,3-thiazolidin-3-ium-3-yl]-1-phenyl-ethanone Openeye Name: 2-[2-[4-hydroxy-1-(hydroxymethyl)-3-methyl-butyl]thiazolidin-3-ium-3-yl]-1-phenyl-ethanone CAS Name: 2-[2-(1,5-dihydroxy-4-methylpentan-2-yl)-3-thiazolidin-3-iumyl]-1-phenylethanone IUPAC Name: 2-[2-(1,5-dihydroxy-4-methylpentan-2-yl)-1,3-thiazolidin-3-ium-3-yl]-1-phenylethanone Traditional Name: 2-[2-(4-hydroxy-3-methyl-1-methylol-butyl)thiazolidin-3-ium-3-yl]-1-phenyl-ethanone Formula: C17H26NO3S+ MolecularWeight: 324.45824

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Descriptors Computed from Structure

Canonical SMILES:

CC(CC(CO)C1[NH+](CCS1)CC(=O)C2=CC=CC=C2)CO

Isomeric SMILES

CC(CC(CO)C1[NH+](CCS1)CC(=O)C2=CC=CC=C2)CO

InChI

InChI=1S/C17H25NO3S/c1-13(11-19)9-15(12-20)17-18(7-8-22-17)10-16(21)14-5-3-2-4-6-14/h2-6,13,15,17,19-20H,7-12H2,1H3/p+1