3,6-didecoxy-2-[diazo-(3,6-didecoxynaphthalen-2-yl)sulfonyl-methyl]sulfonyl-naphthalene

Systemtic Name: 3,6-didecoxy-2-[diazo-(3,6-didecoxynaphthalen-2-yl)sulfonyl-methyl]sulfonyl-naphthalene Openeye Name: 3,6-didecoxy-2-[diazo-[(3,6-didecoxy-2-naphthyl)sulfonyl]methyl]sulfonyl-naphthalene CAS Name: 3,6-didecoxy-2-[diazo-[(3,6-didecoxy-2-naphthalenyl)sulfonyl]methyl]sulfonylnaphthalene IUPAC Name: 3,6-didecoxy-2-[diazo-(3,6-didecoxynaphthalen-2-yl)sulfonylmethyl]sulfonylnaphthalene Traditional Name: 3,6-didecoxy-2-[diazo-[(3,6-didecoxy-2-naphthyl)sulfonyl]methyl]sulfonyl-naphthalene Formula: C61H94N2O8S2 MolecularWeight: 1047.53766

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCOC1=CC2=CC(=C(C=C2C=C1)S(=O)(=O)C(=[N+]=[N-])S(=O)(=O)C3=C(C=C4C=C(C=CC4=C3)OCCCCCCCCCC)OCCCCCCCCCC)OCCCCCCCCCC

Isomeric SMILES

CCCCCCCCCCOC1=CC2=CC(=C(C=C2C=C1)S(=O)(=O)C(=[N+]=[N-])S(=O)(=O)C3=C(C=C4C=C(C=CC4=C3)OCCCCCCCCCC)OCCCCCCCCCC)OCCCCCCCCCC

InChI

InChI=1S/C61H94N2O8S2/c1-5-9-13-17-21-25-29-33-41-68-55-39-37-51-49-59(57(47-53(51)45-55)70-43-35-31-27-23-19-15-11-7-3)72(64,65)61(63-62)73(66,67)60-50-52-38-40-56(69-42-34-30-26-22-18-14-10-6-2)46-54(52)48-58(60)71-44-36-32-28-24-20-16-12-8-4/h37-40,45-50H,5-36,41-44H2,1-4H3