(8Z)-8-[[2-methoxy-4-[3-methoxy-4-[[4-(4-methylphenyl)sulfonyloxyphenyl]diazenyl]phenyl]phenyl]hydrazinylidene]-7-oxidanylidene-naphthalene-1,3-disulfonic acid

Systemtic Name: (8Z)-8-[[2-methoxy-4-[3-methoxy-4-[[4-(4-methylphenyl)sulfonyloxyphenyl]diazenyl]phenyl]phenyl]hydrazinylidene]-7-oxidanylidene-naphthalene-1,3-disulfonic acid Openeye Name: (8Z)-8-[[2-methoxy-4-[3-methoxy-4-[4-(p-tolylsulfonyloxy)phenyl]azo-phenyl]phenyl]hydrazono]-7-oxo-naphthalene-1,3-disulfonic acid CAS Name: (8Z)-8-[[2-methoxy-4-[3-methoxy-4-[4-(4-methylphenyl)sulfonyloxyphenyl]azophenyl]phenyl]hydrazinylidene]-7-oxonaphthalene-1,3-disulfonic acid IUPAC Name: (8Z)-8-[[2-methoxy-4-[3-methoxy-4-[[4-(4-methylphenyl)sulfonyloxyphenyl]diazenyl]phenyl]phenyl]hydrazinylidene]-7-oxonaphthalene-1,3-disulfonic acid Traditional Name: (8Z)-7-keto-8-[[2-methoxy-4-[3-methoxy-4-(4-tosyloxyphenyl)azo-phenyl]phenyl]hydrazono]naphthalene-1,3-disulfonic acid Formula: C37H30N4O12S3 MolecularWeight: 818.8487

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)OC2=CC=C(C=C2)N=NC3=C(C=C(C=C3)C4=CC(=C(C=C4)NN=C5C(=O)C=CC6=CC(=CC(=C65)S(=O)(=O)O)S(=O)(=O)O)OC)OC

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)OC2=CC=C(C=C2)N=NC3=C(C=C(C=C3)C4=CC(=C(C=C4)N/N=C/5\C(=O)C=CC6=CC(=CC(=C65)S(=O)(=O)O)S(=O)(=O)O)OC)OC

InChI

InChI=1S/C37H30N4O12S3/c1-22-4-13-28(14-5-22)56(49,50)53-27-11-9-26(10-12-27)38-39-30-15-6-23(19-33(30)51-2)24-7-16-31(34(20-24)52-3)40-41-37-32(42)17-8-25-18-29(54(43,44)45)21-35(36(25)37)55(46,47)48/h4-21,40H,1-3H3,(H,43,44,45)(H,46,47,48)/b39-38?,41-37+