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

Systemtic Name: (6Z)-4-acetamido-6-[(5-methyl-2-sulfo-phenyl)hydrazinylidene]-5-oxidanylidene-7-(trioxidanylsulfanyl)naphthalene-2-sulfonic acid Openeye Name: (6Z)-4-acetamido-6-[(5-methyl-2-sulfo-phenyl)hydrazono]-5-oxo-7-(trioxidanylsulfanyl)naphthalene-2-sulfonic acid CAS Name: (6Z)-4-acetamido-6-[(5-methyl-2-sulfophenyl)hydrazinylidene]-5-oxo-7-(trioxidanylthio)-2-naphthalenesulfonic acid IUPAC Name: (6Z)-4-acetamido-6-[(5-methyl-2-sulfophenyl)hydrazinylidene]-5-oxo-7-(trioxidanylsulfanyl)naphthalene-2-sulfonic acid Traditional Name: (6Z)-4-acetamido-5-keto-6-[(5-methyl-2-sulfo-phenyl)hydrazono]-7-(trioxidanylthio)naphthalene-2-sulfonic acid Formula: C19H17N3O11S3 MolecularWeight: 559.54678

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)S(=O)(=O)O)NN=C2C(=CC3=CC(=CC(=C3C2=O)NC(=O)C)S(=O)(=O)O)SOOO

Isomeric SMILES

CC1=CC(=C(C=C1)S(=O)(=O)O)N/N=C/2\C(=CC3=CC(=CC(=C3C2=O)NC(=O)C)S(=O)(=O)O)SOOO

InChI

InChI=1S/C19H17N3O11S3/c1-9-3-4-16(36(29,30)31)13(5-9)21-22-18-15(34-33-32-25)7-11-6-12(35(26,27)28)8-14(20-10(2)23)17(11)19(18)24/h3-8,21,25H,1-2H3,(H,20,23)(H,26,27,28)(H,29,30,31)/b22-18+