(5E)-5-[[2-bromanyl-4-(2-sulfooxyethylsulfonyl)phenyl]hydrazinylidene]-6-oxidanylidene-naphthalene-2-sulfonic acid

Systemtic Name: (5E)-5-[[2-bromanyl-4-(2-sulfooxyethylsulfonyl)phenyl]hydrazinylidene]-6-oxidanylidene-naphthalene-2-sulfonic acid Openeye Name: (5E)-5-[[2-bromo-4-(2-sulfooxyethylsulfonyl)phenyl]hydrazono]-6-oxo-naphthalene-2-sulfonic acid CAS Name: (5E)-5-[[2-bromo-4-(2-sulfooxyethylsulfonyl)phenyl]hydrazinylidene]-6-oxo-2-naphthalenesulfonic acid IUPAC Name: (5E)-5-[[2-bromo-4-(2-sulfooxyethylsulfonyl)phenyl]hydrazinylidene]-6-oxonaphthalene-2-sulfonic acid Traditional Name: (5E)-5-[[2-bromo-4-(2-sulfoxyethylsulfonyl)phenyl]hydrazono]-6-keto-naphthalene-2-sulfonic acid Formula: C18H15BrN2O10S3 MolecularWeight: 595.4181

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC2=C(C=CC(=O)C2=NNC3=C(C=C(C=C3)S(=O)(=O)CCOS(=O)(=O)O)Br)C=C1S(=O)(=O)O

Isomeric SMILES

C1=CC\2=C(C=CC(=O)/C2=N/NC3=C(C=C(C=C3)S(=O)(=O)CCOS(=O)(=O)O)Br)C=C1S(=O)(=O)O

InChI

InChI=1S/C18H15BrN2O10S3/c19-15-10-12(32(23,24)8-7-31-34(28,29)30)3-5-16(15)20-21-18-14-4-2-13(33(25,26)27)9-11(14)1-6-17(18)22/h1-6,9-10,20H,7-8H2,(H,25,26,27)(H,28,29,30)/b21-18+