sodium (8E)-4-acetamido-8-[[4-(tert-butylsulfamoyl)phenyl]hydrazinylidene]-5-oxidanylidene-naphthalene-1-sulfonic acid

Systemtic Name: sodium (8E)-4-acetamido-8-[[4-(tert-butylsulfamoyl)phenyl]hydrazinylidene]-5-oxidanylidene-naphthalene-1-sulfonic acid Openeye Name: sodium (8E)-4-acetamido-8-[[4-(tert-butylsulfamoyl)phenyl]hydrazono]-5-oxo-naphthalene-1-sulfonic acid CAS Name: sodium (8E)-4-acetamido-8-[[4-(tert-butylsulfamoyl)phenyl]hydrazinylidene]-5-oxo-1-naphthalenesulfonic acid IUPAC Name: sodium (8E)-4-acetamido-8-[[4-(tert-butylsulfamoyl)phenyl]hydrazinylidene]-5-oxonaphthalene-1-sulfonic acid Traditional Name: sodium (8E)-4-acetamido-8-[[4-(tert-butylsulfamoyl)phenyl]hydrazono]-5-keto-naphthalene-1-sulfonic acid Formula: C22H24N4NaO7S2+ MolecularWeight: 543.56833

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC1=C2C(=O)C=CC(=NNC3=CC=C(C=C3)S(=O)(=O)NC(C)(C)C)C2=C(C=C1)S(=O)(=O)O.[Na+]

Isomeric SMILES

CC(=O)NC1=C2C(=O)C=C/C(=N\NC3=CC=C(C=C3)S(=O)(=O)NC(C)(C)C)/C2=C(C=C1)S(=O)(=O)O.[Na+]

InChI

InChI=1S/C22H24N4O7S2.Na/c1-13(27)23-16-10-12-19(35(31,32)33)21-17(9-11-18(28)20(16)21)25-24-14-5-7-15(8-6-14)34(29,30)26-22(2,3)4;/h5-12,24,26H,1-4H3,(H,23,27)(H,31,32,33);/q;+1/b25-17+;