(6E)-6-[[5-acetamido-2-methoxy-4-[[2-sulfo-5-(trioxidanylsulfanyl)phenyl]diazenyl]phenyl]hydrazinylidene]-4-methyl-5-oxidanylidene-7-(trioxidanylsulfanyl)naphthalene-2-sulfonic acid

Systemtic Name: (6E)-6-[[5-acetamido-2-methoxy-4-[[2-sulfo-5-(trioxidanylsulfanyl)phenyl]diazenyl]phenyl]hydrazinylidene]-4-methyl-5-oxidanylidene-7-(trioxidanylsulfanyl)naphthalene-2-sulfonic acid Openeye Name: (6E)-6-[[5-acetamido-2-methoxy-4-[2-sulfo-5-(trioxidanylsulfanyl)phenyl]azo-phenyl]hydrazono]-4-methyl-5-oxo-7-(trioxidanylsulfanyl)naphthalene-2-sulfonic acid CAS Name: (6E)-6-[[5-acetamido-2-methoxy-4-[2-sulfo-5-(trioxidanylthio)phenyl]azophenyl]hydrazinylidene]-4-methyl-5-oxo-7-(trioxidanylthio)-2-naphthalenesulfonic acid IUPAC Name: (6E)-6-[[5-acetamido-2-methoxy-4-[[2-sulfo-5-(trioxidanylsulfanyl)phenyl]diazenyl]phenyl]hydrazinylidene]-4-methyl-5-oxo-7-(trioxidanylsulfanyl)naphthalene-2-sulfonic acid Traditional Name: (6E)-6-[[5-acetamido-2-methoxy-4-[2-sulfo-5-(trioxidanylthio)phenyl]azo-phenyl]hydrazono]-5-keto-4-methyl-7-(trioxidanylthio)naphthalene-2-sulfonic acid Formula: C26H23N5O15S4 MolecularWeight: 773.74532

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C2C(=CC(=C1)S(=O)(=O)O)C=C(C(=NNC3=C(C=C(C(=C3)NC(=O)C)N=NC4=C(C=CC(=C4)SOOO)S(=O)(=O)O)OC)C2=O)SOOO

Isomeric SMILES

CC1=C2C(=CC(=C1)S(=O)(=O)O)C=C(/C(=N/NC3=C(C=C(C(=C3)NC(=O)C)N=NC4=C(C=CC(=C4)SOOO)S(=O)(=O)O)OC)/C2=O)SOOO

InChI

InChI=1S/C26H23N5O15S4/c1-12-6-16(49(36,37)38)7-14-8-22(48-46-44-35)25(26(33)24(12)14)31-29-19-10-17(27-13(2)32)18(11-21(19)42-3)28-30-20-9-15(47-45-43-34)4-5-23(20)50(39,40)41/h4-11,29,34-35H,1-3H3,(H,27,32)(H,36,37,38)(H,39,40,41)/b30-28?,31-25-