potassium 3-[(2E)-2-(3-ethanoyl-4-oxidanylidene-pent-2-enylidene)-4,4-dimethyl-1,3-oxazolidin-3-yl]propane-1-sulfonate

Systemtic Name: potassium 3-[(2E)-2-(3-ethanoyl-4-oxidanylidene-pent-2-enylidene)-4,4-dimethyl-1,3-oxazolidin-3-yl]propane-1-sulfonate Openeye Name: potassium 3-[(2E)-2-(3-acetyl-4-oxo-pent-2-enylidene)-4,4-dimethyl-oxazolidin-3-yl]propane-1-sulfonate CAS Name: potassium 3-[(2E)-2-(3-acetyl-4-oxopent-2-enylidene)-4,4-dimethyl-3-oxazolidinyl]-1-propanesulfonate IUPAC Name: potassium 3-[(2E)-2-(3-acetyl-4-oxopent-2-enylidene)-4,4-dimethyl-1,3-oxazolidin-3-yl]propane-1-sulfonate Traditional Name: potassium 3-[(2E)-2-(3-acetyl-4-keto-pent-2-enylidene)-4,4-dimethyl-oxazolidin-3-yl]propane-1-sulfonate Formula: C15H22KNO6S MolecularWeight: 383.50158

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C(=CC=C1N(C(CO1)(C)C)CCCS(=O)(=O)[O-])C(=O)C.[K+]

Isomeric SMILES

CC(=O)C(=C/C=C/1\N(C(CO1)(C)C)CCCS(=O)(=O)[O-])C(=O)C.[K+]

InChI

InChI=1S/C15H23NO6S.K/c1-11(17)13(12(2)18)6-7-14-16(15(3,4)10-22-14)8-5-9-23(19,20)21;/h6-7H,5,8-10H2,1-4H3,(H,19,20,21);/q;+1/p-1/b14-7+;