(5E)-5-[[3-nitro-2-oxidanyl-5-(2-sulfooxyethylsulfonyl)phenyl]hydrazinylidene]-6-oxidanylidene-naphthalene-2-sulfonic acid

Systemtic Name: (5E)-5-[[3-nitro-2-oxidanyl-5-(2-sulfooxyethylsulfonyl)phenyl]hydrazinylidene]-6-oxidanylidene-naphthalene-2-sulfonic acid Openeye Name: (5E)-5-[[2-hydroxy-3-nitro-5-(2-sulfooxyethylsulfonyl)phenyl]hydrazono]-6-oxo-naphthalene-2-sulfonic acid CAS Name: (5E)-5-[[2-hydroxy-3-nitro-5-(2-sulfooxyethylsulfonyl)phenyl]hydrazinylidene]-6-oxo-2-naphthalenesulfonic acid IUPAC Name: (5E)-5-[[2-hydroxy-3-nitro-5-(2-sulfooxyethylsulfonyl)phenyl]hydrazinylidene]-6-oxonaphthalene-2-sulfonic acid Traditional Name: (5E)-5-[[2-hydroxy-3-nitro-5-(2-sulfoxyethylsulfonyl)phenyl]hydrazono]-6-keto-naphthalene-2-sulfonic acid Formula: C18H15N3O13S3 MolecularWeight: 577.519

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC2=C(C=CC(=O)C2=NNC3=CC(=CC(=C3O)[N+](=O)[O-])S(=O)(=O)CCOS(=O)(=O)O)C=C1S(=O)(=O)O

Isomeric SMILES

C1=CC\2=C(C=CC(=O)/C2=N/NC3=CC(=CC(=C3O)[N+](=O)[O-])S(=O)(=O)CCOS(=O)(=O)O)C=C1S(=O)(=O)O

InChI

InChI=1S/C18H15N3O13S3/c22-16-4-1-10-7-11(36(28,29)30)2-3-13(10)17(16)20-19-14-8-12(9-15(18(14)23)21(24)25)35(26,27)6-5-34-37(31,32)33/h1-4,7-9,19,23H,5-6H2,(H,28,29,30)(H,31,32,33)/b20-17+