3-[[2-methoxy-4-[(4-sulfophenyl)diazenyl]phenyl]hydrazinylidene]-4-oxidanylidene-naphthalene-1-sulfonic acid

Systemtic Name: 3-[[2-methoxy-4-[(4-sulfophenyl)diazenyl]phenyl]hydrazinylidene]-4-oxidanylidene-naphthalene-1-sulfonic acid Openeye Name: 3-[[2-methoxy-4-(4-sulfophenyl)azo-phenyl]hydrazono]-4-oxo-naphthalene-1-sulfonic acid CAS Name: 3-[[2-methoxy-4-(4-sulfophenyl)azophenyl]hydrazinylidene]-4-oxo-1-naphthalenesulfonic acid IUPAC Name: 3-[[2-methoxy-4-[(4-sulfophenyl)diazenyl]phenyl]hydrazinylidene]-4-oxonaphthalene-1-sulfonic acid Traditional Name: 4-keto-3-[[2-methoxy-4-(4-sulfophenyl)azo-phenyl]hydrazono]naphthalene-1-sulfonic acid Formula: C23H18N4O8S2 MolecularWeight: 542.54102

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=CC(=C1)N=NC2=CC=C(C=C2)S(=O)(=O)O)NN=C3C=C(C4=CC=CC=C4C3=O)S(=O)(=O)O

Isomeric SMILES

COC1=C(C=CC(=C1)N=NC2=CC=C(C=C2)S(=O)(=O)O)NN=C3C=C(C4=CC=CC=C4C3=O)S(=O)(=O)O

InChI

InChI=1S/C23H18N4O8S2/c1-35-21-12-15(25-24-14-6-9-16(10-7-14)36(29,30)31)8-11-19(21)26-27-20-13-22(37(32,33)34)17-4-2-3-5-18(17)23(20)28/h2-13,26H,1H3,(H,29,30,31)(H,32,33,34)