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

Systemtic Name: (5E)-5-[[2-methoxy-5-methyl-4-(trioxidanylsulfanyl)phenyl]hydrazinylidene]-6-oxidanylidene-naphthalene-2-sulfonic acid Openeye Name: (5E)-5-[[2-methoxy-5-methyl-4-(trioxidanylsulfanyl)phenyl]hydrazono]-6-oxo-naphthalene-2-sulfonic acid CAS Name: (5E)-5-[[2-methoxy-5-methyl-4-(trioxidanylthio)phenyl]hydrazinylidene]-6-oxo-2-naphthalenesulfonic acid IUPAC Name: (5E)-5-[[2-methoxy-5-methyl-4-(trioxidanylsulfanyl)phenyl]hydrazinylidene]-6-oxonaphthalene-2-sulfonic acid Traditional Name: (5E)-6-keto-5-[[2-methoxy-5-methyl-4-(trioxidanylthio)phenyl]hydrazono]naphthalene-2-sulfonic acid Formula: C18H16N2O8S2 MolecularWeight: 452.45824

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1SOOO)OC)NN=C2C3=C(C=CC2=O)C=C(C=C3)S(=O)(=O)O

Isomeric SMILES

CC1=CC(=C(C=C1SOOO)OC)N/N=C/2\C3=C(C=CC2=O)C=C(C=C3)S(=O)(=O)O

InChI

InChI=1S/C18H16N2O8S2/c1-10-7-14(16(26-2)9-17(10)29-28-27-22)19-20-18-13-5-4-12(30(23,24)25)8-11(13)3-6-15(18)21/h3-9,19,22H,1-2H3,(H,23,24,25)/b20-18+