sodium; benzene; 1-oxidanylidenebutane-1-sulfonate

Systemtic Name: sodium; benzene; 1-oxidanylidenebutane-1-sulfonate Openeye Name: sodium; benzene; 1-oxobutane-1-sulfonate CAS Name: sodium; benzene; 1-oxo-1-butanesulfonate IUPAC Name: sodium; benzene; 1-oxobutane-1-sulfonate Traditional Name: sodium; benzene; 1-ketobutane-1-sulfonate Formula: C10H12NaO4S- MolecularWeight: 251.25465

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(=O)S(=O)(=O)[O-].C1=CC=[C-]C=C1.[Na+]

Isomeric SMILES

CCCC(=O)S(=O)(=O)[O-].C1=CC=[C-]C=C1.[Na+]

InChI

InChI=1S/C6H5.C4H8O4S.Na/c1-2-4-6-5-3-1;1-2-3-4(5)9(6,7)8;/h1-5H;2-3H2,1H3,(H,6,7,8);/q-1;;+1/p-1