(3E)-5-azanyl-7-methyl-4-oxidanylidene-3-[(2-oxidanyl-4-propoxysulfinyl-phenyl)hydrazinylidene]naphthalene-2-sulfonic acid; copper

Systemtic Name: (3E)-5-azanyl-7-methyl-4-oxidanylidene-3-[(2-oxidanyl-4-propoxysulfinyl-phenyl)hydrazinylidene]naphthalene-2-sulfonic acid; copper Openeye Name: (3E)-5-amino-3-[(2-hydroxy-4-propoxysulfinyl-phenyl)hydrazono]-7-methyl-4-oxo-naphthalene-2-sulfonic acid; copper CAS Name: (3E)-5-amino-3-[(2-hydroxy-4-propoxysulfinylphenyl)hydrazinylidene]-7-methyl-4-oxo-2-naphthalenesulfonic acid; copper IUPAC Name: (3E)-5-amino-3-[(2-hydroxy-4-propoxysulfinylphenyl)hydrazinylidene]-7-methyl-4-oxonaphthalene-2-sulfonic acid; copper Traditional Name: (3E)-5-amino-3-[(2-hydroxy-4-propoxysulfinyl-phenyl)hydrazono]-4-keto-7-methyl-naphthalene-2-sulfonic acid; copper Formula: C20H21CuN3O7S2 MolecularWeight: 543.07264

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Descriptors Computed from Structure

Canonical SMILES:

CCCOS(=O)C1=CC(=C(C=C1)NN=C2C(=CC3=CC(=CC(=C3C2=O)N)C)S(=O)(=O)O)O.[Cu]

Isomeric SMILES

CCCOS(=O)C1=CC(=C(C=C1)N/N=C\2/C(=CC3=CC(=CC(=C3C2=O)N)C)S(=O)(=O)O)O.[Cu]

InChI

InChI=1S/C20H21N3O7S2.Cu/c1-3-6-30-31(26)13-4-5-15(16(24)10-13)22-23-19-17(32(27,28)29)9-12-7-11(2)8-14(21)18(12)20(19)25;/h4-5,7-10,22,24H,3,6,21H2,1-2H3,(H,27,28,29);/b23-19-;