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

Systemtic Name: (6E)-4-azanyl-5-oxidanylidene-3-[[4-(2-sulfooxyethylsulfonyl)phenyl]diazenyl]-6-[[4-(2-sulfooxyethylsulfonyl)phenyl]hydrazinylidene]naphthalene-2,7-disulfonic acid Openeye Name: (6E)-4-amino-5-oxo-3-[4-(2-sulfooxyethylsulfonyl)phenyl]azo-6-[[4-(2-sulfooxyethylsulfonyl)phenyl]hydrazono]naphthalene-2,7-disulfonic acid CAS Name: (6E)-4-amino-5-oxo-3-[4-(2-sulfooxyethylsulfonyl)phenyl]azo-6-[[4-(2-sulfooxyethylsulfonyl)phenyl]hydrazinylidene]naphthalene-2,7-disulfonic acid IUPAC Name: (6E)-4-amino-5-oxo-3-[[4-(2-sulfooxyethylsulfonyl)phenyl]diazenyl]-6-[[4-(2-sulfooxyethylsulfonyl)phenyl]hydrazinylidene]naphthalene-2,7-disulfonic acid Traditional Name: (6E)-4-amino-5-keto-3-[4-(2-sulfoxyethylsulfonyl)phenyl]azo-6-[[4-(2-sulfoxyethylsulfonyl)phenyl]hydrazono]naphthalene-2,7-disulfonic acid Formula: C26H25N5O19S6 MolecularWeight: 903.8888

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1NN=C2C(=CC3=CC(=C(C(=C3C2=O)N)N=NC4=CC=C(C=C4)S(=O)(=O)CCOS(=O)(=O)O)S(=O)(=O)O)S(=O)(=O)O)S(=O)(=O)CCOS(=O)(=O)O

Isomeric SMILES

C1=CC(=CC=C1N/N=C\2/C(=CC3=CC(=C(C(=C3C2=O)N)N=NC4=CC=C(C=C4)S(=O)(=O)CCOS(=O)(=O)O)S(=O)(=O)O)S(=O)(=O)O)S(=O)(=O)CCOS(=O)(=O)O

InChI

InChI=1S/C26H25N5O19S6/c27-23-22-15(13-20(53(37,38)39)24(23)30-28-16-1-5-18(6-2-16)51(33,34)11-9-49-55(43,44)45)14-21(54(40,41)42)25(26(22)32)31-29-17-3-7-19(8-4-17)52(35,36)12-10-50-56(46,47)48/h1-8,13-14,29H,9-12,27H2,(H,37,38,39)(H,40,41,42)(H,43,44,45)(H,46,47,48)/b30-28?,31-25-