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

Systemtic Name: (4E)-4-[(4-methyl-2-sulfo-phenyl)hydrazinylidene]-3-oxidanylidene-naphthalene-2-sulfonic acid Openeye Name: (4E)-4-[(4-methyl-2-sulfo-phenyl)hydrazono]-3-oxo-naphthalene-2-sulfonic acid CAS Name: (4E)-4-[(4-methyl-2-sulfophenyl)hydrazinylidene]-3-oxo-2-naphthalenesulfonic acid IUPAC Name: (4E)-4-[(4-methyl-2-sulfophenyl)hydrazinylidene]-3-oxonaphthalene-2-sulfonic acid Traditional Name: (4E)-3-keto-4-[(4-methyl-2-sulfo-phenyl)hydrazono]naphthalene-2-sulfonic acid Formula: C17H14N2O7S2 MolecularWeight: 422.43226

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)NN=C2C3=CC=CC=C3C=C(C2=O)S(=O)(=O)O)S(=O)(=O)O

Isomeric SMILES

CC1=CC(=C(C=C1)N/N=C/2\C3=CC=CC=C3C=C(C2=O)S(=O)(=O)O)S(=O)(=O)O

InChI

InChI=1S/C17H14N2O7S2/c1-10-6-7-13(14(8-10)27(21,22)23)18-19-16-12-5-3-2-4-11(12)9-15(17(16)20)28(24,25)26/h2-9,18H,1H3,(H,21,22,23)(H,24,25,26)/b19-16+