(3E)-3-[(3-nitro-2-oxidanyl-5-sulfo-phenyl)hydrazinylidene]-4-oxidanylidene-7-phenylazanyl-naphthalene-2-sulfonic acid

Systemtic Name: (3E)-3-[(3-nitro-2-oxidanyl-5-sulfo-phenyl)hydrazinylidene]-4-oxidanylidene-7-phenylazanyl-naphthalene-2-sulfonic acid Openeye Name: (3E)-7-anilino-3-[(2-hydroxy-3-nitro-5-sulfo-phenyl)hydrazono]-4-oxo-naphthalene-2-sulfonic acid CAS Name: (3E)-7-anilino-3-[(2-hydroxy-3-nitro-5-sulfophenyl)hydrazinylidene]-4-oxo-2-naphthalenesulfonic acid IUPAC Name: (3E)-7-anilino-3-[(2-hydroxy-3-nitro-5-sulfophenyl)hydrazinylidene]-4-oxonaphthalene-2-sulfonic acid Traditional Name: (3E)-7-anilino-3-[(2-hydroxy-3-nitro-5-sulfo-phenyl)hydrazono]-4-keto-naphthalene-2-sulfonic acid Formula: C22H16N4O10S2 MolecularWeight: 560.51324

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)NC2=CC3=C(C=C2)C(=O)C(=NNC4=CC(=CC(=C4O)[N+](=O)[O-])S(=O)(=O)O)C(=C3)S(=O)(=O)O

Isomeric SMILES

C1=CC=C(C=C1)NC2=CC3=C(C=C2)C(=O)/C(=N\NC4=CC(=CC(=C4O)[N+](=O)[O-])S(=O)(=O)O)/C(=C3)S(=O)(=O)O

InChI

InChI=1S/C22H16N4O10S2/c27-21-16-7-6-14(23-13-4-2-1-3-5-13)8-12(16)9-19(38(34,35)36)20(21)25-24-17-10-15(37(31,32)33)11-18(22(17)28)26(29)30/h1-11,23-24,28H,(H,31,32,33)(H,34,35,36)/b25-20-