Molecule Identification Common Name ({13-[6-(acetyloxy)-2,5,7,8-tetramethyl-3,4-dihydro-2H-1-benzopyran-2-yl]-2,6,10-trimethyltridecyl}oxy)sulfonic acid Definition Based on a literature review very few articles have been published on ({13-[6-(acetyloxy)-2,5,7,8-tetramethyl-3,4-dihydro-2H-1-benzopyran-2-yl]-2,6,10-trimethyltridecyl}oxy)sulfonic acid. Structure CC(CCCC(C)CCCC1(C)CCC2=C(C)C(OC(C)=O)=C(C)C(C)=C2O1)CCCC(C)COS(O)(=O)=O InChI=1S/C31H52O7S/c1-21(14-10-15-23(3)20-36-39(33,34)35)12-9-13-22(2)16-11-18-31(8)19-17-28-26(6)29(37-27(7)32)24(4)25(5)30(28)38-31/h21-23H,9-20H2,1-8H3,(H,33,34,35) Synonyms Value Source ({13-[6-(acetyloxy)-2,5,7,8-tetramethyl-3,4-dihydro-2H-1-benzopyran-2-yl]-2,6,10-trimethyltridecyl}oxy)sulfonate Generator ({13-[6-(acetyloxy)-2,5,7,8-tetramethyl-3,4-dihydro-2H-1-benzopyran-2-yl]-2,6,10-trimethyltridecyl}oxy)sulphonate Generator ({13-[6-(acetyloxy)-2,5,7,8-tetramethyl-3,4-dihydro-2H-1-benzopyran-2-yl]-2,6,10-trimethyltridecyl}oxy)sulphonic acid Generator
Chemical Formula C31 H52 O7 S Average Molecular Weight 568.81 Monoisotopic Molecular Weight 568.343375188 IUPAC Name ({13-[6-(acetyloxy)-2,5,7,8-tetramethyl-3,4-dihydro-2H-1-benzopyran-2-yl]-2,6,10-trimethyltridecyl}oxy)sulfonic acid Traditional Name {13-[6-(acetyloxy)-2,5,7,8-tetramethyl-3,4-dihydro-1-benzopyran-2-yl]-2,6,10-trimethyltridecyl}oxysulfonic acid CAS Registry Number Not Available SMILES CC(CCCC(C)CCCC1(C)CCC2=C(C)C(OC(C)=O)=C(C)C(C)=C2O1)CCCC(C)COS(O)(=O)=O
InChI Identifier InChI=1S/C31H52O7S/c1-21(14-10-15-23(3)20-36-39(33,34)35)12-9-13-22(2)16-11-18-31(8)19-17-28-26(6)29(37-27(7)32)24(4)25(5)30(28)38-31/h21-23H,9-20H2,1-8H3,(H,33,34,35)
InChI Key PAKRVWHHRCLBPY-UHFFFAOYSA-N 
