2-oxidanidyl-5-[[4-[4-[2-[5-[(2-oxidanidyl-5-sulfonato-phenyl)hydrazinylidene]-2,6-bis(oxidanylidene)cyclohex-3-en-1-ylidene]hydrazinyl]phenyl]phenyl]diazenyl]benzoate

Systemtic Name: 2-oxidanidyl-5-[[4-[4-[2-[5-[(2-oxidanidyl-5-sulfonato-phenyl)hydrazinylidene]-2,6-bis(oxidanylidene)cyclohex-3-en-1-ylidene]hydrazinyl]phenyl]phenyl]diazenyl]benzoate Openeye Name: 2-oxido-5-[4-[4-[2-[5-[(2-oxido-5-sulfonato-phenyl)hydrazono]-2,6-dioxo-cyclohex-3-en-1-ylidene]hydrazino]phenyl]phenyl]azo-benzoate CAS Name: 2-oxido-5-[4-[4-[2-[5-[(2-oxido-5-sulfonatophenyl)hydrazinylidene]-2,6-dioxo-1-cyclohex-3-enylidene]hydrazinyl]phenyl]phenyl]azobenzoate IUPAC Name: 2-oxido-5-[[4-[4-[2-[5-[(2-oxido-5-sulfonatophenyl)hydrazinylidene]-2,6-dioxocyclohex-3-en-1-ylidene]hydrazinyl]phenyl]phenyl]diazenyl]benzoate Traditional Name: 5-[4-[4-[N'-[2,6-diketo-5-[(2-oxido-5-sulfonato-phenyl)hydrazono]cyclohex-3-en-1-ylidene]hydrazino]phenyl]phenyl]azo-2-oxido-benzoate Formula: C31H18N6O9S-4 MolecularWeight: 650.57442

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1C2=CC=C(C=C2)N=NC3=CC(=C(C=C3)[O-])C(=O)[O-])NN=C4C(=O)C=CC(=NNC5=C(C=CC(=C5)S(=O)(=O)[O-])[O-])C4=O

Isomeric SMILES

C1=CC(=CC=C1C2=CC=C(C=C2)N=NC3=CC(=C(C=C3)[O-])C(=O)[O-])NN=C4C(=O)C=CC(=NNC5=C(C=CC(=C5)S(=O)(=O)[O-])[O-])C4=O

InChI

InChI=1S/C31H22N6O9S/c38-26-12-9-21(15-23(26)31(42)43)34-32-19-5-1-17(2-6-19)18-3-7-20(8-4-18)33-37-29-28(40)14-11-24(30(29)41)35-36-25-16-22(47(44,45)46)10-13-27(25)39/h1-16,33,36,38-39H,(H,42,43)(H,44,45,46)/p-4