2-[diazo-(3,6-didodecoxynaphthalen-2-yl)sulfonyl-methyl]sulfonyl-3,6-didodecoxy-naphthalene

Systemtic Name: 2-[diazo-(3,6-didodecoxynaphthalen-2-yl)sulfonyl-methyl]sulfonyl-3,6-didodecoxy-naphthalene Openeye Name: 2-[diazo-[(3,6-didodecoxy-2-naphthyl)sulfonyl]methyl]sulfonyl-3,6-didodecoxy-naphthalene CAS Name: 2-[diazo-[(3,6-didodecoxy-2-naphthalenyl)sulfonyl]methyl]sulfonyl-3,6-didodecoxynaphthalene IUPAC Name: 2-[diazo-(3,6-didodecoxynaphthalen-2-yl)sulfonylmethyl]sulfonyl-3,6-didodecoxynaphthalene Traditional Name: 2-[diazo-[(3,6-dilauryloxy-2-naphthyl)sulfonyl]methyl]sulfonyl-3,6-dilauryloxy-naphthalene Formula: C69H110N2O8S2 MolecularWeight: 1159.7503

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCOC1=CC2=CC(=C(C=C2C=C1)S(=O)(=O)C(=[N+]=[N-])S(=O)(=O)C3=C(C=C4C=C(C=CC4=C3)OCCCCCCCCCCCC)OCCCCCCCCCCCC)OCCCCCCCCCCCC

Isomeric SMILES

CCCCCCCCCCCCOC1=CC2=CC(=C(C=C2C=C1)S(=O)(=O)C(=[N+]=[N-])S(=O)(=O)C3=C(C=C4C=C(C=CC4=C3)OCCCCCCCCCCCC)OCCCCCCCCCCCC)OCCCCCCCCCCCC

InChI

InChI=1S/C69H110N2O8S2/c1-5-9-13-17-21-25-29-33-37-41-49-76-63-47-45-59-57-67(65(55-61(59)53-63)78-51-43-39-35-31-27-23-19-15-11-7-3)80(72,73)69(71-70)81(74,75)68-58-60-46-48-64(77-50-42-38-34-30-26-22-18-14-10-6-2)54-62(60)56-66(68)79-52-44-40-36-32-28-24-20-16-12-8-4/h45-48,53-58H,5-44,49-52H2,1-4H3