4-ethanoyl-7-phenyl-3a,4,7,7a-tetrahydro-2-benzofuran-1,3-dione

Systemtic Name: 4-ethanoyl-7-phenyl-3a,4,7,7a-tetrahydro-2-benzofuran-1,3-dione Openeye Name: 4-acetyl-7-phenyl-3a,4,7,7a-tetrahydroisobenzofuran-1,3-dione CAS Name: 4-acetyl-7-phenyl-3a,4,7,7a-tetrahydroisobenzofuran-1,3-dione IUPAC Name: 4-acetyl-7-phenyl-3a,4,7,7a-tetrahydro-2-benzofuran-1,3-dione Traditional Name: 4-acetyl-7-phenyl-3a,4,7,7a-tetrahydroisobenzofuran-1,3-quinone Formula: C16H14O4 MolecularWeight: 270.27996

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C1C=CC(C2C1C(=O)OC2=O)C3=CC=CC=C3

Isomeric SMILES

CC(=O)C1C=CC(C2C1C(=O)OC2=O)C3=CC=CC=C3

InChI

InChI=1S/C16H14O4/c1-9(17)11-7-8-12(10-5-3-2-4-6-10)14-13(11)15(18)20-16(14)19/h2-8,11-14H,1H3