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

Systemtic Name: (3Z)-3-[[2-methyl-4-[3-methyl-4-[[4-(4-methylphenyl)sulfonyloxyphenyl]diazenyl]phenyl]phenyl]hydrazinylidene]-4-oxidanylidene-naphthalene-2,7-disulfonic acid Openeye Name: (3Z)-3-[[2-methyl-4-[3-methyl-4-[4-(p-tolylsulfonyloxy)phenyl]azo-phenyl]phenyl]hydrazono]-4-oxo-naphthalene-2,7-disulfonic acid CAS Name: (3Z)-3-[[2-methyl-4-[3-methyl-4-[4-(4-methylphenyl)sulfonyloxyphenyl]azophenyl]phenyl]hydrazinylidene]-4-oxonaphthalene-2,7-disulfonic acid IUPAC Name: (3Z)-3-[[2-methyl-4-[3-methyl-4-[[4-(4-methylphenyl)sulfonyloxyphenyl]diazenyl]phenyl]phenyl]hydrazinylidene]-4-oxonaphthalene-2,7-disulfonic acid Traditional Name: (3Z)-4-keto-3-[[2-methyl-4-[3-methyl-4-(4-tosyloxyphenyl)azo-phenyl]phenyl]hydrazono]naphthalene-2,7-disulfonic acid Formula: C37H30N4O10S3 MolecularWeight: 786.8499

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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(=CC6=C(C5=O)C=CC(=C6)S(=O)(=O)O)S(=O)(=O)O)C)C

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(=CC6=C(C5=O)C=CC(=C6)S(=O)(=O)O)S(=O)(=O)O)C)C

InChI

InChI=1S/C37H30N4O10S3/c1-22-4-12-30(13-5-22)54(49,50)51-29-10-8-28(9-11-29)38-39-33-16-6-25(18-23(33)2)26-7-17-34(24(3)19-26)40-41-36-35(53(46,47)48)21-27-20-31(52(43,44)45)14-15-32(27)37(36)42/h4-21,40H,1-3H3,(H,43,44,45)(H,46,47,48)/b39-38?,41-36+