3-ethylpentanoic acid; 2H-pyran-4-ol

Systemtic Name: 3-ethylpentanoic acid; 2H-pyran-4-ol Openeye Name: 3-ethylpentanoic acid; 2H-pyran-4-ol CAS Name: 3-ethylpentanoic acid; 2H-pyran-4-ol IUPAC Name: 3-ethylpentanoic acid; 2H-pyran-4-ol Traditional Name: 3-ethylvaleric acid; 2H-pyran-4-ol Formula: C12H20O4 MolecularWeight: 228.2848

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Descriptors Computed from Structure

Canonical SMILES:

CCC(CC)CC(=O)O.C1C=C(C=CO1)O

Isomeric SMILES

CCC(CC)CC(=O)O.C1C=C(C=CO1)O

InChI

InChI=1S/C7H14O2.C5H6O2/c1-3-6(4-2)5-7(8)9;6-5-1-3-7-4-2-5/h6H,3-5H2,1-2H3,(H,8,9);1-3,6H,4H2