(6E)-4-methyl-5-oxidanylidene-6-[(2-sulfophenyl)hydrazinylidene]-7-(trioxidanylsulfanyl)naphthalene-2-sulfonic acid

Systemtic Name: (6E)-4-methyl-5-oxidanylidene-6-[(2-sulfophenyl)hydrazinylidene]-7-(trioxidanylsulfanyl)naphthalene-2-sulfonic acid Openeye Name: (6E)-4-methyl-5-oxo-6-[(2-sulfophenyl)hydrazono]-7-(trioxidanylsulfanyl)naphthalene-2-sulfonic acid CAS Name: (6E)-4-methyl-5-oxo-6-[(2-sulfophenyl)hydrazinylidene]-7-(trioxidanylthio)-2-naphthalenesulfonic acid IUPAC Name: (6E)-4-methyl-5-oxo-6-[(2-sulfophenyl)hydrazinylidene]-7-(trioxidanylsulfanyl)naphthalene-2-sulfonic acid Traditional Name: (6E)-5-keto-4-methyl-6-[(2-sulfophenyl)hydrazono]-7-(trioxidanylthio)naphthalene-2-sulfonic acid Formula: C17H14N2O10S3 MolecularWeight: 502.49546

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C2C(=CC(=C1)S(=O)(=O)O)C=C(C(=NNC3=CC=CC=C3S(=O)(=O)O)C2=O)SOOO

Isomeric SMILES

CC1=C2C(=CC(=C1)S(=O)(=O)O)C=C(/C(=N/NC3=CC=CC=C3S(=O)(=O)O)/C2=O)SOOO

InChI

InChI=1S/C17H14N2O10S3/c1-9-6-11(31(22,23)24)7-10-8-13(30-29-28-21)16(17(20)15(9)10)19-18-12-4-2-3-5-14(12)32(25,26)27/h2-8,18,21H,1H3,(H,22,23,24)(H,25,26,27)/b19-16-