sodium 5-[(E)-[oxidanidyl(propan-2-yl)azaniumylidene]methyl]furan-2-sulfonate

Systemtic Name: sodium 5-[(E)-[oxidanidyl(propan-2-yl)azaniumylidene]methyl]furan-2-sulfonate Openeye Name: sodium 5-[(E)-[isopropyl(oxido)iminio]methyl]furan-2-sulfonate CAS Name: sodium 5-[(E)-[oxido(propan-2-yl)iminio]methyl]-2-furansulfonate IUPAC Name: sodium 5-[(E)-[oxido(propan-2-yl)azaniumylidene]methyl]furan-2-sulfonate Traditional Name: sodium 5-[(E)-[isopropyl(oxido)iminio]methyl]furan-2-sulfonate Formula: C8H10NNaO5S MolecularWeight: 255.22347

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)[N+](=CC1=CC=C(O1)S(=O)(=O)[O-])[O-].[Na+]

Isomeric SMILES

CC(C)/[N+](=C\C1=CC=C(O1)S(=O)(=O)[O-])/[O-].[Na+]

InChI

InChI=1S/C8H11NO5S.Na/c1-6(2)9(10)5-7-3-4-8(14-7)15(11,12)13;/h3-6H,1-2H3,(H,11,12,13);/q;+1/p-1/b9-5+;