sodium (3E)-6-azanyl-3-[(2-methoxy-4-phenyldiazenyl-phenyl)hydrazinylidene]-4-oxidanylidene-naphthalene-2-sulfonate

Systemtic Name: sodium (3E)-6-azanyl-3-[(2-methoxy-4-phenyldiazenyl-phenyl)hydrazinylidene]-4-oxidanylidene-naphthalene-2-sulfonate Openeye Name: sodium (3E)-6-amino-3-[(2-methoxy-4-phenylazo-phenyl)hydrazono]-4-oxo-naphthalene-2-sulfonate CAS Name: sodium (3E)-6-amino-3-[(2-methoxy-4-phenyldiazenylphenyl)hydrazinylidene]-4-oxo-2-naphthalenesulfonate IUPAC Name: sodium (3E)-6-amino-3-[(2-methoxy-4-phenyldiazenylphenyl)hydrazinylidene]-4-oxonaphthalene-2-sulfonate Traditional Name: sodium (3E)-6-amino-4-keto-3-[(2-methoxy-4-phenylazo-phenyl)hydrazono]naphthalene-2-sulfonate Formula: C23H18N5NaO5S MolecularWeight: 499.47429

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=CC(=C1)N=NC2=CC=CC=C2)NN=C3C(=CC4=C(C3=O)C=C(C=C4)N)S(=O)(=O)[O-].[Na+]

Isomeric SMILES

COC1=C(C=CC(=C1)N=NC2=CC=CC=C2)N/N=C\3/C(=CC4=C(C3=O)C=C(C=C4)N)S(=O)(=O)[O-].[Na+]

InChI

InChI=1S/C23H19N5O5S.Na/c1-33-20-13-17(26-25-16-5-3-2-4-6-16)9-10-19(20)27-28-22-21(34(30,31)32)11-14-7-8-15(24)12-18(14)23(22)29;/h2-13,27H,24H2,1H3,(H,30,31,32);/q;+1/p-1/b26-25?,28-22-;