potassium 4-[1,3-bis(oxidanylidene)isoindol-2-yl]butane-1-sulfonate

Systemtic Name: potassium 4-[1,3-bis(oxidanylidene)isoindol-2-yl]butane-1-sulfonate Openeye Name: potassium 4-(1,3-dioxoisoindolin-2-yl)butane-1-sulfonate CAS Name: potassium 4-(1,3-dioxo-2-isoindolyl)-1-butanesulfonate IUPAC Name: potassium 4-(1,3-dioxoisoindol-2-yl)butane-1-sulfonate Traditional Name: potassium 4-phthalimidobutane-1-sulfonate Formula: C12H12KNO5S MolecularWeight: 321.39068

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=O)N(C2=O)CCCCS(=O)(=O)[O-].[K+]

Isomeric SMILES

C1=CC=C2C(=C1)C(=O)N(C2=O)CCCCS(=O)(=O)[O-].[K+]

InChI

InChI=1S/C12H13NO5S.K/c14-11-9-5-1-2-6-10(9)12(15)13(11)7-3-4-8-19(16,17)18;/h1-2,5-6H,3-4,7-8H2,(H,16,17,18);/q;+1/p-1