(6E)-4-azanyl-6-[(2,4-dichlorophenyl)hydrazinylidene]-5-oxidanylidene-3-[[3-(2-sulfooxyethylsulfamoyl)phenyl]diazenyl]-7-(trioxidanylsulfanyl)naphthalene-2-sulfonic acid

Systemtic Name: (6E)-4-azanyl-6-[(2,4-dichlorophenyl)hydrazinylidene]-5-oxidanylidene-3-[[3-(2-sulfooxyethylsulfamoyl)phenyl]diazenyl]-7-(trioxidanylsulfanyl)naphthalene-2-sulfonic acid Openeye Name: (6E)-4-amino-6-[(2,4-dichlorophenyl)hydrazono]-5-oxo-3-[3-(2-sulfooxyethylsulfamoyl)phenyl]azo-7-(trioxidanylsulfanyl)naphthalene-2-sulfonic acid CAS Name: (6E)-4-amino-6-[(2,4-dichlorophenyl)hydrazinylidene]-5-oxo-3-[3-(2-sulfooxyethylsulfamoyl)phenyl]azo-7-(trioxidanylthio)-2-naphthalenesulfonic acid IUPAC Name: (6E)-4-amino-6-[(2,4-dichlorophenyl)hydrazinylidene]-5-oxo-3-[[3-(2-sulfooxyethylsulfamoyl)phenyl]diazenyl]-7-(trioxidanylsulfanyl)naphthalene-2-sulfonic acid Traditional Name: (6E)-4-amino-6-[(2,4-dichlorophenyl)hydrazono]-5-keto-3-[3-(2-sulfoxyethylsulfamoyl)phenyl]azo-7-(trioxidanylthio)naphthalene-2-sulfonic acid Formula: C24H20Cl2N6O13S4 MolecularWeight: 799.614

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)S(=O)(=O)NCCOS(=O)(=O)O)N=NC2=C(C=C3C=C(C(=NNC4=C(C=C(C=C4)Cl)Cl)C(=O)C3=C2N)SOOO)S(=O)(=O)O

Isomeric SMILES

C1=CC(=CC(=C1)S(=O)(=O)NCCOS(=O)(=O)O)N=NC2=C(C=C3C=C(/C(=N/NC4=C(C=C(C=C4)Cl)Cl)/C(=O)C3=C2N)SOOO)S(=O)(=O)O

InChI

InChI=1S/C24H20Cl2N6O13S4/c25-13-4-5-17(16(26)10-13)30-31-22-18(46-45-44-34)8-12-9-19(48(37,38)39)23(21(27)20(12)24(22)33)32-29-14-2-1-3-15(11-14)47(35,36)28-6-7-43-49(40,41)42/h1-5,8-11,28,30,34H,6-7,27H2,(H,37,38,39)(H,40,41,42)/b31-22-,32-29?