2-azanyl-3-[1,4-bis(oxidanylidene)-4-(2-sulfinooxyethylamino)-1-[[2,5,7,8-tetramethyl-2-(4,8,12-trimethyltridecyl)-3,4-dihydrochromen-6-yl]oxy]butan-2-yl]sulfanyl-propanoic acid

Systemtic Name: 2-azanyl-3-[1,4-bis(oxidanylidene)-4-(2-sulfinooxyethylamino)-1-[[2,5,7,8-tetramethyl-2-(4,8,12-trimethyltridecyl)-3,4-dihydrochromen-6-yl]oxy]butan-2-yl]sulfanyl-propanoic acid Openeye Name: 2-amino-3-[3-oxo-3-(2-sulfinooxyethylamino)-1-[2,5,7,8-tetramethyl-2-(4,8,12-trimethyltridecyl)chroman-6-yl]oxycarbonyl-propyl]sulfanyl-propanoic acid CAS Name: 2-amino-3-[[1,4-dioxo-4-(2-sulfinooxyethylamino)-1-[[2,5,7,8-tetramethyl-2-(4,8,12-trimethyltridecyl)-3,4-dihydro-2H-1-benzopyran-6-yl]oxy]butan-2-yl]thio]propanoic acid IUPAC Name: 2-amino-3-[1,4-dioxo-4-(2-sulfinooxyethylamino)-1-[[2,5,7,8-tetramethyl-2-(4,8,12-trimethyltridecyl)-3,4-dihydrochromen-6-yl]oxy]butan-2-yl]sulfanylpropanoic acid Traditional Name: 2-amino-3-[[3-keto-3-(2-sulfinooxyethylamino)-1-[2,5,7,8-tetramethyl-2-(4,8,12-trimethyltridecyl)chroman-6-yl]oxycarbonyl-propyl]thio]propionic acid Formula: C38H64N2O9S2 MolecularWeight: 757.05276

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C2C(=C(C(=C1C)OC(=O)C(CC(=O)NCCOS(=O)O)SCC(C(=O)O)N)C)CCC(O2)(C)CCCC(C)CCCC(C)CCCC(C)C

Isomeric SMILES

CC1=C2C(=C(C(=C1C)OC(=O)C(CC(=O)NCCOS(=O)O)SCC(C(=O)O)N)C)CCC(O2)(C)CCCC(C)CCCC(C)CCCC(C)C

InChI

InChI=1S/C38H64N2O9S2/c1-24(2)12-9-13-25(3)14-10-15-26(4)16-11-18-38(8)19-17-30-29(7)34(27(5)28(6)35(30)49-38)48-37(44)32(50-23-31(39)36(42)43)22-33(41)40-20-21-47-51(45)46/h24-26,31-32H,9-23,39H2,1-8H3,(H,40,41)(H,42,43)(H,45,46)