(5E)-5-[(2-methoxy-5-methyl-3-sulfo-phenyl)hydrazinylidene]-6-oxidanylidene-naphthalene-2-sulfonic acid

Systemtic Name: (5E)-5-[(2-methoxy-5-methyl-3-sulfo-phenyl)hydrazinylidene]-6-oxidanylidene-naphthalene-2-sulfonic acid Openeye Name: (5E)-5-[(2-methoxy-5-methyl-3-sulfo-phenyl)hydrazono]-6-oxo-naphthalene-2-sulfonic acid CAS Name: (5E)-5-[(2-methoxy-5-methyl-3-sulfophenyl)hydrazinylidene]-6-oxo-2-naphthalenesulfonic acid IUPAC Name: (5E)-5-[(2-methoxy-5-methyl-3-sulfophenyl)hydrazinylidene]-6-oxonaphthalene-2-sulfonic acid Traditional Name: (5E)-6-keto-5-[(2-methoxy-5-methyl-3-sulfo-phenyl)hydrazono]naphthalene-2-sulfonic acid Formula: C18H16N2O8S2 MolecularWeight: 452.45824

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C(=C1)S(=O)(=O)O)OC)NN=C2C3=C(C=CC2=O)C=C(C=C3)S(=O)(=O)O

Isomeric SMILES

CC1=CC(=C(C(=C1)S(=O)(=O)O)OC)N/N=C/2\C3=C(C=CC2=O)C=C(C=C3)S(=O)(=O)O

InChI

InChI=1S/C18H16N2O8S2/c1-10-7-14(18(28-2)16(8-10)30(25,26)27)19-20-17-13-5-4-12(29(22,23)24)9-11(13)3-6-15(17)21/h3-9,19H,1-2H3,(H,22,23,24)(H,25,26,27)/b20-17+