(4-ethyl-5-propanoyl-furan-2-yl)phosphonic acid

Systemtic Name: (4-ethyl-5-propanoyl-furan-2-yl)phosphonic acid Openeye Name: (4-ethyl-5-propanoyl-2-furyl)phosphonic acid CAS Name: [4-ethyl-5-(1-oxopropyl)-2-furanyl]phosphonic acid IUPAC Name: (4-ethyl-5-propanoylfuran-2-yl)phosphonic acid Traditional Name: (4-ethyl-5-propionyl-2-furyl)phosphonic acid Formula: C9H13O5P MolecularWeight: 232.170281

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(OC(=C1)P(=O)(O)O)C(=O)CC

Isomeric SMILES

CCC1=C(OC(=C1)P(=O)(O)O)C(=O)CC

InChI

InChI=1S/C9H13O5P/c1-3-6-5-8(15(11,12)13)14-9(6)7(10)4-2/h5H,3-4H2,1-2H3,(H2,11,12,13)