5-[4-[2-[4-(6-diazonio-5-oxidanyl-naphthalen-1-yl)sulfonyloxyphenyl]-5-oxidanyl-5-oxidanylidene-pentan-2-yl]phenoxy]sulfonyl-1-oxidanyl-naphthalene-2-diazonium

Systemtic Name: 5-[4-[2-[4-(6-diazonio-5-oxidanyl-naphthalen-1-yl)sulfonyloxyphenyl]-5-oxidanyl-5-oxidanylidene-pentan-2-yl]phenoxy]sulfonyl-1-oxidanyl-naphthalene-2-diazonium Openeye Name: 5-[4-[1-[4-[(6-diazonio-5-hydroxy-1-naphthyl)sulfonyloxy]phenyl]-4-hydroxy-1-methyl-4-oxo-butyl]phenoxy]sulfonyl-1-hydroxy-naphthalene-2-diazonium CAS Name: 5-[4-[2-[4-[(6-diazonio-5-hydroxy-1-naphthalenyl)sulfonyloxy]phenyl]-5-hydroxy-5-oxopentan-2-yl]phenoxy]sulfonyl-1-hydroxy-2-naphthalenediazonium IUPAC Name: 5-[4-[2-[4-(6-diazonio-5-hydroxynaphthalen-1-yl)sulfonyloxyphenyl]-5-hydroxy-5-oxopentan-2-yl]phenoxy]sulfonyl-1-hydroxynaphthalene-2-diazonium Traditional Name: 5-[4-[1-[4-[(6-diazonio-5-hydroxy-1-naphthyl)sulfonyloxy]phenyl]-4-hydroxy-4-keto-1-methyl-butyl]phenoxy]sulfonyl-1-hydroxy-naphthalene-2-diazonium Formula: C37H28N4O10S2+2 MolecularWeight: 752.76902

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Descriptors Computed from Structure

Canonical SMILES:

CC(CCC(=O)O)(C1=CC=C(C=C1)OS(=O)(=O)C2=CC=CC3=C2C=CC(=C3O)[N+]#N)C4=CC=C(C=C4)OS(=O)(=O)C5=CC=CC6=C5C=CC(=C6O)[N+]#N

Isomeric SMILES

CC(CCC(=O)O)(C1=CC=C(C=C1)OS(=O)(=O)C2=CC=CC3=C2C=CC(=C3O)[N+]#N)C4=CC=C(C=C4)OS(=O)(=O)C5=CC=CC6=C5C=CC(=C6O)[N+]#N

InChI

InChI=1S/C37H26N4O10S2/c1-37(21-20-34(42)43,22-8-12-24(13-9-22)50-52(46,47)32-6-2-4-28-26(32)16-18-30(40-38)35(28)44)23-10-14-25(15-11-23)51-53(48,49)33-7-3-5-29-27(33)17-19-31(41-39)36(29)45/h2-19H,20-21H2,1H3,(H-2,42,43,44,45)/p+2