3-[3-(3H-1,2-benzodioxol-6-yl)propanoyl]-6-methyl-pyran-2,4-dione

Systemtic Name: 3-[3-(3H-1,2-benzodioxol-6-yl)propanoyl]-6-methyl-pyran-2,4-dione Openeye Name: 3-[3-(3H-1,2-benzodioxol-6-yl)propanoyl]-6-methyl-pyran-2,4-dione CAS Name: 3-[3-(3H-1,2-benzodioxol-6-yl)-1-oxopropyl]-6-methylpyran-2,4-dione IUPAC Name: 3-[3-(3H-1,2-benzodioxol-6-yl)propanoyl]-6-methylpyran-2,4-dione Traditional Name: 3-[3-(3H-1,2-benzodioxol-6-yl)propanoyl]-6-methyl-pyran-2,4-quinone Formula: C16H14O6 MolecularWeight: 302.27876

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=O)C(C(=O)O1)C(=O)CCC2=CC3=C(COO3)C=C2

Isomeric SMILES

CC1=CC(=O)C(C(=O)O1)C(=O)CCC2=CC3=C(COO3)C=C2

InChI

InChI=1S/C16H14O6/c1-9-6-13(18)15(16(19)21-9)12(17)5-3-10-2-4-11-8-20-22-14(11)7-10/h2,4,6-7,15H,3,5,8H2,1H3