(3Z)-5-azanyl-3-[(1,5-disulfonaphthalen-2-yl)hydrazinylidene]-4-oxidanylidene-6-[[3-(2-sulfooxyethylsulfonyl)phenyl]diazenyl]naphthalene-2,7-disulfonic acid

Systemtic Name: (3Z)-5-azanyl-3-[(1,5-disulfonaphthalen-2-yl)hydrazinylidene]-4-oxidanylidene-6-[[3-(2-sulfooxyethylsulfonyl)phenyl]diazenyl]naphthalene-2,7-disulfonic acid Openeye Name: (3Z)-5-amino-3-[(1,5-disulfo-2-naphthyl)hydrazono]-4-oxo-6-[3-(2-sulfooxyethylsulfonyl)phenyl]azo-naphthalene-2,7-disulfonic acid CAS Name: (3Z)-5-amino-3-[(1,5-disulfo-2-naphthalenyl)hydrazinylidene]-4-oxo-6-[3-(2-sulfooxyethylsulfonyl)phenyl]azonaphthalene-2,7-disulfonic acid IUPAC Name: (3Z)-5-amino-3-[(1,5-disulfonaphthalen-2-yl)hydrazinylidene]-4-oxo-6-[[3-(2-sulfooxyethylsulfonyl)phenyl]diazenyl]naphthalene-2,7-disulfonic acid Traditional Name: (3Z)-5-amino-3-[(1,5-disulfo-2-naphthyl)hydrazono]-4-keto-6-[3-(2-sulfoxyethylsulfonyl)phenyl]azo-naphthalene-2,7-disulfonic acid Formula: C28H23N5O19S6 MolecularWeight: 925.89432

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)S(=O)(=O)CCOS(=O)(=O)O)N=NC2=C(C=C3C=C(C(=NNC4=C(C5=C(C=C4)C(=CC=C5)S(=O)(=O)O)S(=O)(=O)O)C(=O)C3=C2N)S(=O)(=O)O)S(=O)(=O)O

Isomeric SMILES

C1=CC(=CC(=C1)S(=O)(=O)CCOS(=O)(=O)O)N=NC2=C(C=C3C=C(/C(=N\NC4=C(C5=C(C=C4)C(=CC=C5)S(=O)(=O)O)S(=O)(=O)O)/C(=O)C3=C2N)S(=O)(=O)O)S(=O)(=O)O

InChI

InChI=1S/C28H23N5O19S6/c29-24-23-14(11-21(55(40,41)42)25(24)32-30-15-3-1-4-16(13-15)53(35,36)10-9-52-58(49,50)51)12-22(56(43,44)45)26(27(23)34)33-31-19-8-7-17-18(28(19)57(46,47)48)5-2-6-20(17)54(37,38)39/h1-8,11-13,31H,9-10,29H2,(H,37,38,39)(H,40,41,42)(H,43,44,45)(H,46,47,48)(H,49,50,51)/b32-30?,33-26+