(3Z)-3-[[3-nitro-2-oxidanyl-5-(2-sulfooxyethylsulfonyl)phenyl]hydrazinylidene]-4-oxidanylidene-naphthalene-2-sulfonic acid

Systemtic Name: (3Z)-3-[[3-nitro-2-oxidanyl-5-(2-sulfooxyethylsulfonyl)phenyl]hydrazinylidene]-4-oxidanylidene-naphthalene-2-sulfonic acid Openeye Name: (3Z)-3-[[2-hydroxy-3-nitro-5-(2-sulfooxyethylsulfonyl)phenyl]hydrazono]-4-oxo-naphthalene-2-sulfonic acid CAS Name: (3Z)-3-[[2-hydroxy-3-nitro-5-(2-sulfooxyethylsulfonyl)phenyl]hydrazinylidene]-4-oxo-2-naphthalenesulfonic acid IUPAC Name: (3Z)-3-[[2-hydroxy-3-nitro-5-(2-sulfooxyethylsulfonyl)phenyl]hydrazinylidene]-4-oxonaphthalene-2-sulfonic acid Traditional Name: (3Z)-3-[[2-hydroxy-3-nitro-5-(2-sulfoxyethylsulfonyl)phenyl]hydrazono]-4-keto-naphthalene-2-sulfonic acid Formula: C18H15N3O13S3 MolecularWeight: 577.519

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C=C(C(=NNC3=CC(=CC(=C3O)[N+](=O)[O-])S(=O)(=O)CCOS(=O)(=O)O)C2=O)S(=O)(=O)O

Isomeric SMILES

C1=CC=C2C(=C1)C=C(/C(=N\NC3=CC(=CC(=C3O)[N+](=O)[O-])S(=O)(=O)CCOS(=O)(=O)O)/C2=O)S(=O)(=O)O

InChI

InChI=1S/C18H15N3O13S3/c22-17-12-4-2-1-3-10(12)7-15(36(28,29)30)16(17)20-19-13-8-11(9-14(18(13)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)/b20-16+