3-(5,5-dimethyl-3-octadecyl-1,3-thiazolidin-2-yl)-4-oxidanyl-benzenesulfonic acid

Systemtic Name: 3-(5,5-dimethyl-3-octadecyl-1,3-thiazolidin-2-yl)-4-oxidanyl-benzenesulfonic acid Openeye Name: 3-(5,5-dimethyl-3-octadecyl-thiazolidin-2-yl)-4-hydroxy-benzenesulfonic acid CAS Name: 3-(5,5-dimethyl-3-octadecyl-2-thiazolidinyl)-4-hydroxybenzenesulfonic acid IUPAC Name: 3-(5,5-dimethyl-3-octadecyl-1,3-thiazolidin-2-yl)-4-hydroxybenzenesulfonic acid Traditional Name: 3-(5,5-dimethyl-3-stearyl-thiazolidin-2-yl)-4-hydroxy-besylic acid Formula: C29H51NO4S2 MolecularWeight: 541.84954

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCCCN1CC(SC1C2=C(C=CC(=C2)S(=O)(=O)O)O)(C)C

Isomeric SMILES

CCCCCCCCCCCCCCCCCCN1CC(SC1C2=C(C=CC(=C2)S(=O)(=O)O)O)(C)C

InChI

InChI=1S/C29H51NO4S2/c1-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-22-30-24-29(2,3)35-28(30)26-23-25(36(32,33)34)20-21-27(26)31/h20-21,23,28,31H,4-19,22,24H2,1-3H3,(H,32,33,34)