(6E)-4-acetamido-6-[(4-methoxyphenyl)hydrazinylidene]-5-oxidanylidene-7-(trioxidanylsulfanyl)naphthalene-2-sulfonic acid

Systemtic Name: (6E)-4-acetamido-6-[(4-methoxyphenyl)hydrazinylidene]-5-oxidanylidene-7-(trioxidanylsulfanyl)naphthalene-2-sulfonic acid Openeye Name: (6E)-4-acetamido-6-[(4-methoxyphenyl)hydrazono]-5-oxo-7-(trioxidanylsulfanyl)naphthalene-2-sulfonic acid CAS Name: (6E)-4-acetamido-6-[(4-methoxyphenyl)hydrazinylidene]-5-oxo-7-(trioxidanylthio)-2-naphthalenesulfonic acid IUPAC Name: (6E)-4-acetamido-6-[(4-methoxyphenyl)hydrazinylidene]-5-oxo-7-(trioxidanylsulfanyl)naphthalene-2-sulfonic acid Traditional Name: (6E)-4-acetamido-5-keto-6-[(4-methoxyphenyl)hydrazono]-7-(trioxidanylthio)naphthalene-2-sulfonic acid Formula: C19H17N3O9S2 MolecularWeight: 495.48298

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC1=C2C(=CC(=C1)S(=O)(=O)O)C=C(C(=NNC3=CC=C(C=C3)OC)C2=O)SOOO

Isomeric SMILES

CC(=O)NC1=C2C(=CC(=C1)S(=O)(=O)O)C=C(/C(=N/NC3=CC=C(C=C3)OC)/C2=O)SOOO

InChI

InChI=1S/C19H17N3O9S2/c1-10(23)20-15-9-14(33(26,27)28)7-11-8-16(32-31-30-25)18(19(24)17(11)15)22-21-12-3-5-13(29-2)6-4-12/h3-9,21,25H,1-2H3,(H,20,23)(H,26,27,28)/b22-18-