sodium 5-[(Z)-[(4-chlorophenyl)carbonylhydrazinylidene]methyl]furan-2-sulfonate

Systemtic Name: sodium 5-[(Z)-[(4-chlorophenyl)carbonylhydrazinylidene]methyl]furan-2-sulfonate Openeye Name: sodium 5-[(Z)-[(4-chlorobenzoyl)hydrazono]methyl]furan-2-sulfonate CAS Name: sodium 5-[(Z)-[[(4-chlorophenyl)-oxomethyl]hydrazinylidene]methyl]-2-furansulfonate IUPAC Name: sodium 5-[(Z)-[(4-chlorobenzoyl)hydrazinylidene]methyl]furan-2-sulfonate Traditional Name: sodium 5-[(Z)-[(4-chlorobenzoyl)hydrazono]methyl]furan-2-sulfonate Formula: C12H8ClN2NaO5S MolecularWeight: 350.71009

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1C(=O)NN=CC2=CC=C(O2)S(=O)(=O)[O-])Cl.[Na+]

Isomeric SMILES

C1=CC(=CC=C1C(=O)N/N=C\C2=CC=C(O2)S(=O)(=O)[O-])Cl.[Na+]

InChI

InChI=1S/C12H9ClN2O5S.Na/c13-9-3-1-8(2-4-9)12(16)15-14-7-10-5-6-11(20-10)21(17,18)19;/h1-7H,(H,15,16)(H,17,18,19);/q;+1/p-1/b14-7-;