4-(5-methanoyl-5-oxidanyl-3,3a,4,6,7,7a-hexahydro-2H-1-benzofuran-2-yl)butanoic acid

Systemtic Name: 4-(5-methanoyl-5-oxidanyl-3,3a,4,6,7,7a-hexahydro-2H-1-benzofuran-2-yl)butanoic acid Openeye Name: 4-(5-formyl-5-hydroxy-3,3a,4,6,7,7a-hexahydro-2H-benzofuran-2-yl)butanoic acid CAS Name: 4-(5-formyl-5-hydroxy-3,3a,4,6,7,7a-hexahydro-2H-benzofuran-2-yl)butanoic acid IUPAC Name: 4-(5-formyl-5-hydroxy-3,3a,4,6,7,7a-hexahydro-2H-1-benzofuran-2-yl)butanoic acid Traditional Name: 4-(5-formyl-5-hydroxy-3,3a,4,6,7,7a-hexahydro-2H-benzofuran-2-yl)butyric acid Formula: C13H20O5 MolecularWeight: 256.2949

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(CC2C1OC(C2)CCCC(=O)O)(C=O)O

Isomeric SMILES

C1CC(CC2C1OC(C2)CCCC(=O)O)(C=O)O

InChI

InChI=1S/C13H20O5/c14-8-13(17)5-4-11-9(7-13)6-10(18-11)2-1-3-12(15)16/h8-11,17H,1-7H2,(H,15,16)