(Q82630820)

English

Disodium 3-(2-{4-[(E)-(4-anilino-3-sulfonatophenyl)diazenyl]naphthalen-1-yl}hydrazinylidene)-4-oxo-3,4-dihydronaphthalene-1-sulfonate

group of stereoisomers with the chemical formula C₃₂H₂₁N₅Na₂O₇S₂

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instance of

group of stereoisomers

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subclass of

chemical compound

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mass

697.0677785720002 dalton

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based on heuristic

inferred from SMILES

chemical formula

C₃₂H₂₁N₅Na₂O₇S₂

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based on heuristic

inferred from SMILES

canonical SMILES

O=C1C(=NNc2ccc(/N=N/c3ccc(Nc4ccccc4)c(S(=O)(=O)[O-])c3)c3ccccc23)C=C(S(=O)(=O)[O-])c2ccccc21.[Na+].[Na+]

1 reference

based on heuristic

inferred from InChI

isomeric SMILES

O=C1C(=NNc2ccc(/N=N/c3ccc(Nc4ccccc4)c(S(=O)(=O)[O-])c3)c3ccccc23)C=C(S(=O)(=O)[O-])c2ccccc21.[Na+].[Na+]

1 reference

based on heuristic

inferred from InChI

Identifiers

InChI

InChI=1S/C32H23N5O7S2.2Na/c38-32-25-13-7-6-12-24(25)30(45(39,40)41)19-29(32)37-36-27-17-16-26(22-10-4-5-11-23(22)27)35-34-21-14-15-28(31(18-21)46(42,43)44)33-20-8-2-1-3-9-20;;/h1-19,33,36H,(H,39,40,41)(H,42,43,44);;/q;2*+1/p-2/b35-34+,37-29?;;

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InChIKey

MAIOBJQMITWWOV-YDHFSHILSA-L

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DSSTOX compound identifier

DTXCID90650538

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(Q82630820)

Disodium 3-(2-{4-[(E)-(4-anilino-3-sulfonatophenyl)diazenyl]naphthalen-1-yl}hydrazinylidene)-4-oxo-3,4-dihydronaphthalene-1-sulfonate

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