(8E)-8-[[2-bromanyl-4-(2-sulfooxyethylsulfonyl)phenyl]hydrazinylidene]-7-oxidanylidene-naphthalene-1,3-disulfonic acid

Systemtic Name: (8E)-8-[[2-bromanyl-4-(2-sulfooxyethylsulfonyl)phenyl]hydrazinylidene]-7-oxidanylidene-naphthalene-1,3-disulfonic acid Openeye Name: (8E)-8-[[2-bromo-4-(2-sulfooxyethylsulfonyl)phenyl]hydrazono]-7-oxo-naphthalene-1,3-disulfonic acid CAS Name: (8E)-8-[[2-bromo-4-(2-sulfooxyethylsulfonyl)phenyl]hydrazinylidene]-7-oxonaphthalene-1,3-disulfonic acid IUPAC Name: (8E)-8-[[2-bromo-4-(2-sulfooxyethylsulfonyl)phenyl]hydrazinylidene]-7-oxonaphthalene-1,3-disulfonic acid Traditional Name: (8E)-8-[[2-bromo-4-(2-sulfoxyethylsulfonyl)phenyl]hydrazono]-7-keto-naphthalene-1,3-disulfonic acid Formula: C18H15BrN2O13S4 MolecularWeight: 675.4813

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=O)C(=NNC2=C(C=C(C=C2)S(=O)(=O)CCOS(=O)(=O)O)Br)C3=C(C=C(C=C31)S(=O)(=O)O)S(=O)(=O)O

Isomeric SMILES

C1=CC(=O)/C(=N/NC2=C(C=C(C=C2)S(=O)(=O)CCOS(=O)(=O)O)Br)/C3=C(C=C(C=C31)S(=O)(=O)O)S(=O)(=O)O

InChI

InChI=1S/C18H15BrN2O13S4/c19-13-8-11(35(23,24)6-5-34-38(31,32)33)2-3-14(13)20-21-18-15(22)4-1-10-7-12(36(25,26)27)9-16(17(10)18)37(28,29)30/h1-4,7-9,20H,5-6H2,(H,25,26,27)(H,28,29,30)(H,31,32,33)/b21-18-