4,4,5,6,7-pentamethylisochromene-1,3-dione

Systemtic Name: 4,4,5,6,7-pentamethylisochromene-1,3-dione Openeye Name: 4,4,5,6,7-pentamethylisochromane-1,3-dione CAS Name: 4,4,5,6,7-pentamethyl-3,4-dihydro-1H-2-benzopyran-1,3-dione IUPAC Name: 4,4,5,6,7-pentamethylisochromene-1,3-dione Traditional Name: 4,4,5,6,7-pentamethylisochroman-1,3-quinone Formula: C14H16O3 MolecularWeight: 232.27504

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=C2C(=C1)C(=O)OC(=O)C2(C)C)C)C

Isomeric SMILES

CC1=C(C(=C2C(=C1)C(=O)OC(=O)C2(C)C)C)C

InChI

InChI=1S/C14H16O3/c1-7-6-10-11(9(3)8(7)2)14(4,5)13(16)17-12(10)15/h6H,1-5H3