4-ethanoyl-1,3-benzodioxol-2-one; 1-iodanylprop-1-yne

Systemtic Name: 4-ethanoyl-1,3-benzodioxol-2-one; 1-iodanylprop-1-yne Openeye Name: 4-acetyl-1,3-benzodioxol-2-one; 1-iodoprop-1-yne CAS Name: 4-acetyl-1,3-benzodioxol-2-one; 1-iodo-1-propyne IUPAC Name: 4-acetyl-1,3-benzodioxol-2-one; 1-iodoprop-1-yne Traditional Name: 4-acetyl-1,3-benzodioxol-2-one; 1-iodoprop-1-yne Formula: C12H9IO4 MolecularWeight: 344.10193

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Descriptors Computed from Structure

Canonical SMILES:

CC#CI.CC(=O)C1=C2C(=CC=C1)OC(=O)O2

Isomeric SMILES

CC#CI.CC(=O)C1=C2C(=CC=C1)OC(=O)O2

InChI

InChI=1S/C9H6O4.C3H3I/c1-5(10)6-3-2-4-7-8(6)13-9(11)12-7;1-2-3-4/h2-4H,1H3;1H3