4-oxidanylidene-5-propyl-cyclohexa-1,5-diene-1-sulfinate

Systemtic Name: 4-oxidanylidene-5-propyl-cyclohexa-1,5-diene-1-sulfinate Openeye Name: 4-oxo-5-propyl-cyclohexa-1,5-diene-1-sulfinate CAS Name: 4-oxo-5-propyl-1-cyclohexa-1,5-dienesulfinate IUPAC Name: 4-oxo-5-propylcyclohexa-1,5-diene-1-sulfinate Traditional Name: 4-keto-5-propyl-cyclohexa-1,5-diene-1-sulfinate Formula: C9H11O3S- MolecularWeight: 199.24684

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=CC(=CCC1=O)S(=O)[O-]

Isomeric SMILES

CCCC1=CC(=CCC1=O)S(=O)[O-]

InChI

InChI=1S/C9H12O3S/c1-2-3-7-6-8(13(11)12)4-5-9(7)10/h4,6H,2-3,5H2,1H3,(H,11,12)/p-1