(3aS,7R,7aS)-2,2-dimethyl-7-oxidanyl-7,7a-dihydro-3aH-1,3-benzodioxol-4-one

Systemtic Name: (3aS,7R,7aS)-2,2-dimethyl-7-oxidanyl-7,7a-dihydro-3aH-1,3-benzodioxol-4-one Openeye Name: (3aS,7R,7aS)-7-hydroxy-2,2-dimethyl-7,7a-dihydro-3aH-1,3-benzodioxol-4-one CAS Name: (3aS,7R,7aS)-7-hydroxy-2,2-dimethyl-7,7a-dihydro-3aH-1,3-benzodioxol-4-one IUPAC Name: (3aS,7R,7aS)-7-hydroxy-2,2-dimethyl-7,7a-dihydro-3aH-1,3-benzodioxol-4-one Traditional Name: (3aS,7R,7aS)-7-hydroxy-2,2-dimethyl-7,7a-dihydro-3aH-1,3-benzodioxol-4-one Formula: C9H12O4 MolecularWeight: 184.18918

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Descriptors Computed from Structure

Canonical SMILES:

CC1(OC2C(C=CC(=O)C2O1)O)C

Isomeric SMILES

CC1(O[C@H]2[C@@H](C=CC(=O)[C@H]2O1)O)C

InChI

InChI=1S/C9H12O4/c1-9(2)12-7-5(10)3-4-6(11)8(7)13-9/h3-5,7-8,10H,1-2H3/t5-,7+,8-/m1/s1