5-[2,3-bis[(6-diazonio-5-oxidanyl-naphthalen-1-yl)sulfonyloxy]-5-ethoxycarbonyl-phenoxy]sulfonyl-1-oxidanyl-naphthalene-2-diazonium

Systemtic Name: 5-[2,3-bis[(6-diazonio-5-oxidanyl-naphthalen-1-yl)sulfonyloxy]-5-ethoxycarbonyl-phenoxy]sulfonyl-1-oxidanyl-naphthalene-2-diazonium Openeye Name: 5-[2,3-bis[(6-diazonio-5-hydroxy-1-naphthyl)sulfonyloxy]-5-ethoxycarbonyl-phenoxy]sulfonyl-1-hydroxy-naphthalene-2-diazonium CAS Name: 5-[2,3-bis[(6-diazonio-5-hydroxy-1-naphthalenyl)sulfonyloxy]-5-ethoxycarbonylphenoxy]sulfonyl-1-hydroxy-2-naphthalenediazonium IUPAC Name: 5-[2,3-bis[(6-diazonio-5-hydroxynaphthalen-1-yl)sulfonyloxy]-5-ethoxycarbonylphenoxy]sulfonyl-1-hydroxynaphthalene-2-diazonium Traditional Name: 5-[5-carbethoxy-2,3-bis[(6-diazonio-5-hydroxy-1-naphthyl)sulfonyloxy]phenoxy]sulfonyl-1-hydroxy-naphthalene-2-diazonium Formula: C39H25N6O14S3+3 MolecularWeight: 897.8426

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC(=C(C(=C1)OS(=O)(=O)C2=CC=CC3=C2C=CC(=C3O)[N+]#N)OS(=O)(=O)C4=CC=CC5=C4C=CC(=C5O)[N+]#N)OS(=O)(=O)C6=CC=CC7=C6C=CC(=C7O)[N+]#N

Isomeric SMILES

CCOC(=O)C1=CC(=C(C(=C1)OS(=O)(=O)C2=CC=CC3=C2C=CC(=C3O)[N+]#N)OS(=O)(=O)C4=CC=CC5=C4C=CC(=C5O)[N+]#N)OS(=O)(=O)C6=CC=CC7=C6C=CC(=C7O)[N+]#N

InChI

InChI=1S/C39H22N6O14S3/c1-2-56-39(49)20-18-30(57-60(50,51)32-9-3-6-24-21(32)12-15-27(43-40)35(24)46)38(59-62(54,55)34-11-5-8-26-23(34)14-17-29(45-42)37(26)48)31(19-20)58-61(52,53)33-10-4-7-25-22(33)13-16-28(44-41)36(25)47/h3-19H,2H2,1H3/p+3