disodium (3E)-3-[(2-methoxyphenyl)hydrazinylidene]-5-oxidanyl-4-oxidanylidene-naphthalene-1,2-disulfonate

Systemtic Name: disodium (3E)-3-[(2-methoxyphenyl)hydrazinylidene]-5-oxidanyl-4-oxidanylidene-naphthalene-1,2-disulfonate Openeye Name: disodium (3E)-5-hydroxy-3-[(2-methoxyphenyl)hydrazono]-4-oxo-naphthalene-1,2-disulfonate CAS Name: disodium (3E)-5-hydroxy-3-[(2-methoxyphenyl)hydrazinylidene]-4-oxonaphthalene-1,2-disulfonate IUPAC Name: disodium (3E)-5-hydroxy-3-[(2-methoxyphenyl)hydrazinylidene]-4-oxonaphthalene-1,2-disulfonate Traditional Name: disodium (3E)-5-hydroxy-4-keto-3-[(2-methoxyphenyl)hydrazono]naphthalene-1,2-disulfonate Formula: C17H12N2Na2O9S2 MolecularWeight: 498.39472

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC=C1NN=C2C(=C(C3=C(C2=O)C(=CC=C3)O)S(=O)(=O)[O-])S(=O)(=O)[O-].[Na+].[Na+]

Isomeric SMILES

COC1=CC=CC=C1N/N=C\2/C(=C(C3=C(C2=O)C(=CC=C3)O)S(=O)(=O)[O-])S(=O)(=O)[O-].[Na+].[Na+]

InChI

InChI=1S/C17H14N2O9S2.2Na/c1-28-12-8-3-2-6-10(12)18-19-14-15(21)13-9(5-4-7-11(13)20)16(29(22,23)24)17(14)30(25,26)27;;/h2-8,18,20H,1H3,(H,22,23,24)(H,25,26,27);;/q;2*+1/p-2/b19-14+;;