(3E)-6-azanyl-3-[(2-butoxy-4-phenyldiazenyl-phenyl)hydrazinylidene]-4-oxidanylidene-naphthalene-2-sulfonic acid

Systemtic Name: (3E)-6-azanyl-3-[(2-butoxy-4-phenyldiazenyl-phenyl)hydrazinylidene]-4-oxidanylidene-naphthalene-2-sulfonic acid Openeye Name: (3E)-6-amino-3-[(2-butoxy-4-phenylazo-phenyl)hydrazono]-4-oxo-naphthalene-2-sulfonic acid CAS Name: (3E)-6-amino-3-[(2-butoxy-4-phenyldiazenylphenyl)hydrazinylidene]-4-oxo-2-naphthalenesulfonic acid IUPAC Name: (3E)-6-amino-3-[(2-butoxy-4-phenyldiazenylphenyl)hydrazinylidene]-4-oxonaphthalene-2-sulfonic acid Traditional Name: (3E)-6-amino-3-[(2-butoxy-4-phenylazo-phenyl)hydrazono]-4-keto-naphthalene-2-sulfonic acid Formula: C26H25N5O5S MolecularWeight: 519.5722

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC1=C(C=CC(=C1)N=NC2=CC=CC=C2)NN=C3C(=CC4=C(C3=O)C=C(C=C4)N)S(=O)(=O)O

Isomeric SMILES

CCCCOC1=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

InChI

InChI=1S/C26H25N5O5S/c1-2-3-13-36-23-16-20(29-28-19-7-5-4-6-8-19)11-12-22(23)30-31-25-24(37(33,34)35)14-17-9-10-18(27)15-21(17)26(25)32/h4-12,14-16,30H,2-3,13,27H2,1H3,(H,33,34,35)/b29-28?,31-25-