(3E)-5-azanyl-3-[(5-azanyl-2-sulfo-phenyl)hydrazinylidene]-4-oxidanylidene-6-[(8-sulfonaphthalen-2-yl)diazenyl]naphthalene-2,7-disulfonic acid

Systemtic Name: (3E)-5-azanyl-3-[(5-azanyl-2-sulfo-phenyl)hydrazinylidene]-4-oxidanylidene-6-[(8-sulfonaphthalen-2-yl)diazenyl]naphthalene-2,7-disulfonic acid Openeye Name: (3E)-5-amino-3-[(5-amino-2-sulfo-phenyl)hydrazono]-4-oxo-6-[(8-sulfo-2-naphthyl)azo]naphthalene-2,7-disulfonic acid CAS Name: (3E)-5-amino-3-[(5-amino-2-sulfophenyl)hydrazinylidene]-4-oxo-6-[(8-sulfo-2-naphthalenyl)azo]naphthalene-2,7-disulfonic acid IUPAC Name: (3E)-5-amino-3-[(5-amino-2-sulfophenyl)hydrazinylidene]-4-oxo-6-[(8-sulfonaphthalen-2-yl)diazenyl]naphthalene-2,7-disulfonic acid Traditional Name: (3E)-5-amino-3-[(5-amino-2-sulfo-phenyl)hydrazono]-4-keto-6-[(8-sulfo-2-naphthyl)azo]naphthalene-2,7-disulfonic acid Formula: C26H20N6O13S4 MolecularWeight: 752.7294

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC2=C(C=C(C=C2)N=NC3=C(C=C4C=C(C(=NNC5=C(C=CC(=C5)N)S(=O)(=O)O)C(=O)C4=C3N)S(=O)(=O)O)S(=O)(=O)O)C(=C1)S(=O)(=O)O

Isomeric SMILES

C1=CC2=C(C=C(C=C2)N=NC3=C(C=C4C=C(/C(=N/NC5=C(C=CC(=C5)N)S(=O)(=O)O)/C(=O)C4=C3N)S(=O)(=O)O)S(=O)(=O)O)C(=C1)S(=O)(=O)O

InChI

InChI=1S/C26H20N6O13S4/c27-14-5-7-19(47(37,38)39)17(10-14)30-32-25-21(49(43,44)45)9-13-8-20(48(40,41)42)24(23(28)22(13)26(25)33)31-29-15-6-4-12-2-1-3-18(16(12)11-15)46(34,35)36/h1-11,30H,27-28H2,(H,34,35,36)(H,37,38,39)(H,40,41,42)(H,43,44,45)/b31-29?,32-25-