5-[(E)-[[azanyl-(4-oxidanylidenecyclohexa-2,5-dien-1-ylidene)methyl]hydrazinylidene]methyl]furan-2-sulfonate

Systemtic Name: 5-[(E)-[[azanyl-(4-oxidanylidenecyclohexa-2,5-dien-1-ylidene)methyl]hydrazinylidene]methyl]furan-2-sulfonate Openeye Name: 5-[(E)-[[amino-(4-oxocyclohexa-2,5-dien-1-ylidene)methyl]hydrazono]methyl]furan-2-sulfonate CAS Name: 5-[(E)-[[amino-(4-oxo-1-cyclohexa-2,5-dienylidene)methyl]hydrazinylidene]methyl]-2-furansulfonate IUPAC Name: 5-[(E)-[[amino-(4-oxocyclohexa-2,5-dien-1-ylidene)methyl]hydrazinylidene]methyl]furan-2-sulfonate Traditional Name: 5-[(E)-[[amino-(4-ketocyclohexa-2,5-dien-1-ylidene)methyl]hydrazono]methyl]furan-2-sulfonate Formula: C12H10N3O5S- MolecularWeight: 308.2899

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=O)C=CC1=C(N)NN=CC2=CC=C(O2)S(=O)(=O)[O-]

Isomeric SMILES

C1=CC(=O)C=CC1=C(N)N/N=C/C2=CC=C(O2)S(=O)(=O)[O-]

InChI

InChI=1S/C12H11N3O5S/c13-12(8-1-3-9(16)4-2-8)15-14-7-10-5-6-11(20-10)21(17,18)19/h1-7,15H,13H2,(H,17,18,19)/p-1/b14-7+