(3Z)-3-[[2-nitro-4-(2-sulfooxyethylsulfonyl)phenyl]hydrazinylidene]-4-oxidanylidene-naphthalene-2,7-disulfonic acid

Systemtic Name: (3Z)-3-[[2-nitro-4-(2-sulfooxyethylsulfonyl)phenyl]hydrazinylidene]-4-oxidanylidene-naphthalene-2,7-disulfonic acid Openeye Name: (3Z)-3-[[2-nitro-4-(2-sulfooxyethylsulfonyl)phenyl]hydrazono]-4-oxo-naphthalene-2,7-disulfonic acid CAS Name: (3Z)-3-[[2-nitro-4-(2-sulfooxyethylsulfonyl)phenyl]hydrazinylidene]-4-oxonaphthalene-2,7-disulfonic acid IUPAC Name: (3Z)-3-[[2-nitro-4-(2-sulfooxyethylsulfonyl)phenyl]hydrazinylidene]-4-oxonaphthalene-2,7-disulfonic acid Traditional Name: (3Z)-4-keto-3-[[2-nitro-4-(2-sulfoxyethylsulfonyl)phenyl]hydrazono]naphthalene-2,7-disulfonic acid Formula: C18H15N3O15S4 MolecularWeight: 641.5828

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC2=C(C=C1S(=O)(=O)O)C=C(C(=NNC3=C(C=C(C=C3)S(=O)(=O)CCOS(=O)(=O)O)[N+](=O)[O-])C2=O)S(=O)(=O)O

Isomeric SMILES

C1=CC2=C(C=C1S(=O)(=O)O)C=C(/C(=N\NC3=C(C=C(C=C3)S(=O)(=O)CCOS(=O)(=O)O)[N+](=O)[O-])/C2=O)S(=O)(=O)O

InChI

InChI=1S/C18H15N3O15S4/c22-18-13-3-1-12(38(27,28)29)7-10(13)8-16(39(30,31)32)17(18)20-19-14-4-2-11(9-15(14)21(23)24)37(25,26)6-5-36-40(33,34)35/h1-4,7-9,19H,5-6H2,(H,27,28,29)(H,30,31,32)(H,33,34,35)/b20-17+