sodium (5E)-5-[(4,5-diisocyano-1H-imidazol-2-yl)hydrazinylidene]-6-oxidanylidene-naphthalene-2-sulfonate

Systemtic Name: sodium (5E)-5-[(4,5-diisocyano-1H-imidazol-2-yl)hydrazinylidene]-6-oxidanylidene-naphthalene-2-sulfonate Openeye Name: sodium (5E)-5-[(4,5-diisocyano-1H-imidazol-2-yl)hydrazono]-6-oxo-naphthalene-2-sulfonate CAS Name: sodium (5E)-5-[(4,5-diisocyano-1H-imidazol-2-yl)hydrazinylidene]-6-oxo-2-naphthalenesulfonate IUPAC Name: sodium (5E)-5-[(4,5-diisocyano-1H-imidazol-2-yl)hydrazinylidene]-6-oxonaphthalene-2-sulfonate Traditional Name: sodium (5E)-5-[(4,5-diisocyano-1H-imidazol-2-yl)hydrazono]-6-keto-naphthalene-2-sulfonate Formula: C15H7N6NaO4S MolecularWeight: 390.30865

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

[C-]#[N+]C1=C(N=C(N1)NN=C2C3=C(C=CC2=O)C=C(C=C3)S(=O)(=O)[O-])[N+]#[C-].[Na+]

Isomeric SMILES

[C-]#[N+]C1=C(N=C(N1)N/N=C/2\C3=C(C=CC2=O)C=C(C=C3)S(=O)(=O)[O-])[N+]#[C-].[Na+]

InChI

InChI=1S/C15H8N6O4S.Na/c1-16-13-14(17-2)19-15(18-13)21-20-12-10-5-4-9(26(23,24)25)7-8(10)3-6-11(12)22;/h3-7H,(H2,18,19,21)(H,23,24,25);/q;+1/p-1/b20-12+;