copper; (6E)-6-[(5-methyl-2-oxidanyl-3-sulfo-phenyl)hydrazinylidene]-5-oxidanylidene-4-phenylazanyl-naphthalene-1,7-disulfonic acid

Systemtic Name: copper; (6E)-6-[(5-methyl-2-oxidanyl-3-sulfo-phenyl)hydrazinylidene]-5-oxidanylidene-4-phenylazanyl-naphthalene-1,7-disulfonic acid Openeye Name: (6E)-4-anilino-6-[(2-hydroxy-5-methyl-3-sulfo-phenyl)hydrazono]-5-oxo-naphthalene-1,7-disulfonic acid; copper CAS Name: (6E)-4-anilino-6-[(2-hydroxy-5-methyl-3-sulfophenyl)hydrazinylidene]-5-oxonaphthalene-1,7-disulfonic acid; copper IUPAC Name: (6E)-4-anilino-6-[(2-hydroxy-5-methyl-3-sulfophenyl)hydrazinylidene]-5-oxonaphthalene-1,7-disulfonic acid; copper Traditional Name: (6E)-4-anilino-6-[(2-hydroxy-5-methyl-3-sulfo-phenyl)hydrazono]-5-keto-naphthalene-1,7-disulfonic acid; copper Formula: C23H19CuN3O11S3 MolecularWeight: 673.15146

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C(=C1)S(=O)(=O)O)O)NN=C2C(=CC3=C(C=CC(=C3C2=O)NC4=CC=CC=C4)S(=O)(=O)O)S(=O)(=O)O.[Cu]

Isomeric SMILES

CC1=CC(=C(C(=C1)S(=O)(=O)O)O)N/N=C\2/C(=CC3=C(C=CC(=C3C2=O)NC4=CC=CC=C4)S(=O)(=O)O)S(=O)(=O)O.[Cu]

InChI

InChI=1S/C23H19N3O11S3.Cu/c1-12-9-16(22(27)19(10-12)40(35,36)37)25-26-21-18(39(32,33)34)11-14-17(38(29,30)31)8-7-15(20(14)23(21)28)24-13-5-3-2-4-6-13;/h2-11,24-25,27H,1H3,(H,29,30,31)(H,32,33,34)(H,35,36,37);/b26-21-;