(3E)-3-[(2-methyl-4-sulfo-phenyl)hydrazinylidene]-5-oxidanyl-4-oxidanylidene-naphthalene-1-sulfonic acid

Systemtic Name: (3E)-3-[(2-methyl-4-sulfo-phenyl)hydrazinylidene]-5-oxidanyl-4-oxidanylidene-naphthalene-1-sulfonic acid Openeye Name: (3E)-5-hydroxy-3-[(2-methyl-4-sulfo-phenyl)hydrazono]-4-oxo-naphthalene-1-sulfonic acid CAS Name: (3E)-5-hydroxy-3-[(2-methyl-4-sulfophenyl)hydrazinylidene]-4-oxo-1-naphthalenesulfonic acid IUPAC Name: (3E)-5-hydroxy-3-[(2-methyl-4-sulfophenyl)hydrazinylidene]-4-oxonaphthalene-1-sulfonic acid Traditional Name: (3E)-5-hydroxy-4-keto-3-[(2-methyl-4-sulfo-phenyl)hydrazono]naphthalene-1-sulfonic acid Formula: C17H14N2O8S2 MolecularWeight: 438.43166

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)S(=O)(=O)O)NN=C2C=C(C3=C(C2=O)C(=CC=C3)O)S(=O)(=O)O

Isomeric SMILES

CC1=C(C=CC(=C1)S(=O)(=O)O)N/N=C/2\C=C(C3=C(C2=O)C(=CC=C3)O)S(=O)(=O)O

InChI

InChI=1S/C17H14N2O8S2/c1-9-7-10(28(22,23)24)5-6-12(9)18-19-13-8-15(29(25,26)27)11-3-2-4-14(20)16(11)17(13)21/h2-8,18,20H,1H3,(H,22,23,24)(H,25,26,27)/b19-13+