1,31-di-tert-butyl 16-{2-[2-(2-{2-[(4-methylbenzenesulfonyl)oxy]ethoxy}ethoxy)ethoxy]ethyl}-4,7,10,13,19,22,25,28-octaoxa-16-azahentriacontanedioate

CAS: 2112737-74-1

Formula: C45H81NO18S

SMILES: CC1=CC=C(C=C1)S(=O)(=O)OCCOCCOCCOCCN(CCOCCOCCOCCOCCC(=O)OC(C)(C)C)CCOCCOCCOCCOCCC(=O)OC(C)(C)C

IUPAC: 1,31-di-tert-butyl 16-{2-[2-(2-{2-[(4-methylbenzenesulfonyl)oxy]ethoxy}ethoxy)ethoxy]ethyl}-4,7,10,13,19,22,25,28-octaoxa-16-azahentriacontanedioate

InChI: InChI=1S/C45H81NO18S/c1-40-8-10-41(11-9-40)65(49,50)62-39-38-61-37-36-60-31-26-55-21-16-46(14-19-53-24-29-58-34-32-56-27-22-51-17-12-42(47)63-44(2,3)4)15-20-54-25-30-59-35-33-57-28-23-52-18-13-43(48)64-45(5,6)7/h8-11H,12-39H2,1-7H3

Composition: C (56.53%), H (8.54%), N (1.46%), O (30.12%), S (3.35%)

Molar Mass: 956.19

Atom Count: 146

Heavy Atom Count: 65