2,5-bis(oxidanylidene)-1-(3-oxidanylidenebutyl)pyrrole-3-sulfonic acid

Systemtic Name: 2,5-bis(oxidanylidene)-1-(3-oxidanylidenebutyl)pyrrole-3-sulfonic acid Openeye Name: 2,5-dioxo-1-(3-oxobutyl)pyrrole-3-sulfonic acid CAS Name: 2,5-dioxo-1-(3-oxobutyl)-3-pyrrolesulfonic acid IUPAC Name: 2,5-dioxo-1-(3-oxobutyl)pyrrole-3-sulfonic acid Traditional Name: 2,5-diketo-1-(3-ketobutyl)-3-pyrroline-3-sulfonic acid Formula: C8H9NO6S MolecularWeight: 247.22516

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)CCN1C(=O)C=C(C1=O)S(=O)(=O)O

Isomeric SMILES

CC(=O)CCN1C(=O)C=C(C1=O)S(=O)(=O)O

InChI

InChI=1S/C8H9NO6S/c1-5(10)2-3-9-7(11)4-6(8(9)12)16(13,14)15/h4H,2-3H2,1H3,(H,13,14,15)