5-[[2,4-bis(azanyl)-5-[(4-sulfophenyl)diazenyl]phenyl]diazenyl]-8-phenyldiazenyl-naphthalene-1-sulfonic acid

Systemtic Name: 5-[[2,4-bis(azanyl)-5-[(4-sulfophenyl)diazenyl]phenyl]diazenyl]-8-phenyldiazenyl-naphthalene-1-sulfonic acid Openeye Name: 5-[2,4-diamino-5-(4-sulfophenyl)azo-phenyl]azo-8-phenylazo-naphthalene-1-sulfonic acid CAS Name: 5-[2,4-diamino-5-(4-sulfophenyl)azophenyl]azo-8-phenyldiazenyl-1-naphthalenesulfonic acid IUPAC Name: 5-[[2,4-diamino-5-[(4-sulfophenyl)diazenyl]phenyl]diazenyl]-8-phenyldiazenylnaphthalene-1-sulfonic acid Traditional Name: 5-[2,4-diamino-5-(4-sulfophenyl)azo-phenyl]azo-8-phenylazo-naphthalene-1-sulfonic acid Formula: C28H22N8O6S2 MolecularWeight: 630.65428

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)N=NC2=C3C(=C(C=C2)N=NC4=C(C=C(C(=C4)N=NC5=CC=C(C=C5)S(=O)(=O)O)N)N)C=CC=C3S(=O)(=O)O

Isomeric SMILES

C1=CC=C(C=C1)N=NC2=C3C(=C(C=C2)N=NC4=C(C=C(C(=C4)N=NC5=CC=C(C=C5)S(=O)(=O)O)N)N)C=CC=C3S(=O)(=O)O

InChI

InChI=1S/C28H22N8O6S2/c29-21-15-22(30)26(16-25(21)35-32-18-9-11-19(12-10-18)43(37,38)39)36-33-23-13-14-24(34-31-17-5-2-1-3-6-17)28-20(23)7-4-8-27(28)44(40,41)42/h1-16H,29-30H2,(H,37,38,39)(H,40,41,42)