(3S,7aR)-3-methoxy-4,7a-dimethyl-6,7-dihydro-3H-2-benzofuran-1,5-dione

Systemtic Name: (3S,7aR)-3-methoxy-4,7a-dimethyl-6,7-dihydro-3H-2-benzofuran-1,5-dione Openeye Name: (3S,7aR)-3-methoxy-4,7a-dimethyl-6,7-dihydro-3H-isobenzofuran-1,5-dione CAS Name: (3S,7aR)-3-methoxy-4,7a-dimethyl-6,7-dihydro-3H-isobenzofuran-1,5-dione IUPAC Name: (3S,7aR)-3-methoxy-4,7a-dimethyl-6,7-dihydro-3H-2-benzofuran-1,5-dione Traditional Name: (3S,7aR)-3-methoxy-4,7a-dimethyl-6,7-dihydro-3H-isobenzofuran-1,5-quinone Formula: C11H14O4 MolecularWeight: 210.22646

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C2C(OC(=O)C2(CCC1=O)C)OC

Isomeric SMILES

CC1=C2[C@H](OC(=O)[C@@]2(CCC1=O)C)OC

InChI

InChI=1S/C11H14O4/c1-6-7(12)4-5-11(2)8(6)9(14-3)15-10(11)13/h9H,4-5H2,1-3H3/t9-,11+/m0/s1