ditert-butyl 11,25-bis(hydroxymethyl)-3,17-dimethyl-4,18-bis(oxidanyl)-1,15-diazacyclooctacosane-1,15-dicarboxylate

Systemtic Name: ditert-butyl 11,25-bis(hydroxymethyl)-3,17-dimethyl-4,18-bis(oxidanyl)-1,15-diazacyclooctacosane-1,15-dicarboxylate Openeye Name: ditert-butyl 4,18-dihydroxy-11,25-bis(hydroxymethyl)-3,17-dimethyl-1,15-diazacyclooctacosane-1,15-dicarboxylate CAS Name: 4,18-dihydroxy-11,25-bis(hydroxymethyl)-3,17-dimethyl-1,15-diazacyclooctacosane-1,15-dicarboxylic acid ditert-butyl ester IUPAC Name: ditert-butyl 4,18-dihydroxy-11,25-bis(hydroxymethyl)-3,17-dimethyl-1,15-diazacyclooctacosane-1,15-dicarboxylate Traditional Name: 4,18-dihydroxy-3,17-dimethyl-11,25-dimethylol-1,15-diazacyclooctacosane-1,15-dicarboxylic acid ditert-butyl ester Formula: C40H78N2O8 MolecularWeight: 715.05592

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Descriptors Computed from Structure

Canonical SMILES:

CC1CN(CCCC(CCCCCCC(C(CN(CCCC(CCCCCCC1O)CO)C(=O)OC(C)(C)C)C)O)CO)C(=O)OC(C)(C)C

Isomeric SMILES

CC1CN(CCCC(CCCCCCC(C(CN(CCCC(CCCCCCC1O)CO)C(=O)OC(C)(C)C)C)O)CO)C(=O)OC(C)(C)C

InChI

InChI=1S/C40H78N2O8/c1-31-27-41(37(47)49-39(3,4)5)25-17-21-33(29-43)20-14-10-12-16-24-36(46)32(2)28-42(38(48)50-40(6,7)8)26-18-22-34(30-44)19-13-9-11-15-23-35(31)45/h31-36,43-46H,9-30H2,1-8H3