sodium 5-[(E)-(phenylcarbonylhydrazinylidene)methyl]furan-2-sulfonate

Systemtic Name: sodium 5-[(E)-(phenylcarbonylhydrazinylidene)methyl]furan-2-sulfonate Openeye Name: sodium 5-[(E)-(benzoylhydrazono)methyl]furan-2-sulfonate CAS Name: sodium 5-[(E)-(benzoylhydrazinylidene)methyl]-2-furansulfonate IUPAC Name: sodium 5-[(E)-(benzoylhydrazinylidene)methyl]furan-2-sulfonate Traditional Name: sodium 5-[(E)-(benzoylhydrazono)methyl]furan-2-sulfonate Formula: C12H9N2NaO5S MolecularWeight: 316.26503

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C(=O)NN=CC2=CC=C(O2)S(=O)(=O)[O-].[Na+]

Isomeric SMILES

C1=CC=C(C=C1)C(=O)N/N=C/C2=CC=C(O2)S(=O)(=O)[O-].[Na+]

InChI

InChI=1S/C12H10N2O5S.Na/c15-12(9-4-2-1-3-5-9)14-13-8-10-6-7-11(19-10)20(16,17)18;/h1-8H,(H,14,15)(H,16,17,18);/q;+1/p-1/b13-8+;