(3E)-3-[(2-methoxy-5-methylsulfonyl-phenyl)hydrazinylidene]-7-methyl-5-(methylamino)-4-oxidanylidene-naphthalene-2-sulfonic acid

Systemtic Name: (3E)-3-[(2-methoxy-5-methylsulfonyl-phenyl)hydrazinylidene]-7-methyl-5-(methylamino)-4-oxidanylidene-naphthalene-2-sulfonic acid Openeye Name: (3E)-3-[(2-methoxy-5-methylsulfonyl-phenyl)hydrazono]-7-methyl-5-(methylamino)-4-oxo-naphthalene-2-sulfonic acid CAS Name: (3E)-3-[(2-methoxy-5-methylsulfonylphenyl)hydrazinylidene]-7-methyl-5-(methylamino)-4-oxo-2-naphthalenesulfonic acid IUPAC Name: (3E)-3-[(2-methoxy-5-methylsulfonylphenyl)hydrazinylidene]-7-methyl-5-(methylamino)-4-oxonaphthalene-2-sulfonic acid Traditional Name: (3E)-4-keto-3-[(5-mesyl-2-methoxy-phenyl)hydrazono]-7-methyl-5-(methylamino)naphthalene-2-sulfonic acid Formula: C20H21N3O7S2 MolecularWeight: 479.52664

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C2C(=C1)C=C(C(=NNC3=C(C=CC(=C3)S(=O)(=O)C)OC)C2=O)S(=O)(=O)O)NC

Isomeric SMILES

CC1=CC(=C2C(=C1)C=C(/C(=N/NC3=C(C=CC(=C3)S(=O)(=O)C)OC)/C2=O)S(=O)(=O)O)NC

InChI

InChI=1S/C20H21N3O7S2/c1-11-7-12-9-17(32(27,28)29)19(20(24)18(12)15(8-11)21-2)23-22-14-10-13(31(4,25)26)5-6-16(14)30-3/h5-10,21-22H,1-4H3,(H,27,28,29)/b23-19-