2-[diazo-(2,5-didodecoxyphenyl)sulfonyl-methyl]sulfonyl-1,4-didodecoxy-benzene

Systemtic Name: 2-[diazo-(2,5-didodecoxyphenyl)sulfonyl-methyl]sulfonyl-1,4-didodecoxy-benzene Openeye Name: 2-[diazo-(2,5-didodecoxyphenyl)sulfonyl-methyl]sulfonyl-1,4-didodecoxy-benzene CAS Name: 2-[diazo-(2,5-didodecoxyphenyl)sulfonylmethyl]sulfonyl-1,4-didodecoxybenzene IUPAC Name: 2-[diazo-(2,5-didodecoxyphenyl)sulfonylmethyl]sulfonyl-1,4-didodecoxybenzene Traditional Name: 2-[diazo-(2,5-dilauryloxyphenyl)sulfonyl-methyl]sulfonyl-1,4-dilauryloxy-benzene Formula: C61H106N2O8S2 MolecularWeight: 1059.63294

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCOC1=CC(=C(C=C1)OCCCCCCCCCCCC)S(=O)(=O)C(=[N+]=[N-])S(=O)(=O)C2=C(C=CC(=C2)OCCCCCCCCCCCC)OCCCCCCCCCCCC

Isomeric SMILES

CCCCCCCCCCCCOC1=CC(=C(C=C1)OCCCCCCCCCCCC)S(=O)(=O)C(=[N+]=[N-])S(=O)(=O)C2=C(C=CC(=C2)OCCCCCCCCCCCC)OCCCCCCCCCCCC

InChI

InChI=1S/C61H106N2O8S2/c1-5-9-13-17-21-25-29-33-37-41-49-68-55-45-47-57(70-51-43-39-35-31-27-23-19-15-11-7-3)59(53-55)72(64,65)61(63-62)73(66,67)60-54-56(69-50-42-38-34-30-26-22-18-14-10-6-2)46-48-58(60)71-52-44-40-36-32-28-24-20-16-12-8-4/h45-48,53-54H,5-44,49-52H2,1-4H3