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

Systemtic Name: (3E)-3-[[3-(methylamino)-2-oxidanyl-5-sulfo-phenyl]hydrazinylidene]-4-oxidanylidene-naphthalene-2-sulfonic acid Openeye Name: (3E)-3-[[2-hydroxy-3-(methylamino)-5-sulfo-phenyl]hydrazono]-4-oxo-naphthalene-2-sulfonic acid CAS Name: (3E)-3-[[2-hydroxy-3-(methylamino)-5-sulfophenyl]hydrazinylidene]-4-oxo-2-naphthalenesulfonic acid IUPAC Name: (3E)-3-[[2-hydroxy-3-(methylamino)-5-sulfophenyl]hydrazinylidene]-4-oxonaphthalene-2-sulfonic acid Traditional Name: (3E)-3-[[2-hydroxy-3-(methylamino)-5-sulfo-phenyl]hydrazono]-4-keto-naphthalene-2-sulfonic acid Formula: C17H15N3O8S2 MolecularWeight: 453.4463

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Descriptors Computed from Structure

Canonical SMILES:

CNC1=CC(=CC(=C1O)NN=C2C(=CC3=CC=CC=C3C2=O)S(=O)(=O)O)S(=O)(=O)O

Isomeric SMILES

CNC1=CC(=CC(=C1O)N/N=C\2/C(=CC3=CC=CC=C3C2=O)S(=O)(=O)O)S(=O)(=O)O

InChI

InChI=1S/C17H15N3O8S2/c1-18-12-7-10(29(23,24)25)8-13(17(12)22)19-20-15-14(30(26,27)28)6-9-4-2-3-5-11(9)16(15)21/h2-8,18-19,22H,1H3,(H,23,24,25)(H,26,27,28)/b20-15-