methyl 2,4-bis(oxidanyl)-6-pentyl-benzoate

Systemtic Name: methyl 2,4-bis(oxidanyl)-6-pentyl-benzoate Openeye Name: methyl 2,4-dihydroxy-6-pentyl-benzoate CAS Name: 2,4-dihydroxy-6-pentylbenzoic acid methyl ester IUPAC Name: methyl 2,4-dihydroxy-6-pentylbenzoate Traditional Name: 2-amyl-4,6-dihydroxy-benzoic acid methyl ester Formula: C13H18O4 MolecularWeight: 238.27962

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC1=CC(=CC(=C1C(=O)OC)O)O

Isomeric SMILES

CCCCCC1=CC(=CC(=C1C(=O)OC)O)O

InChI

InChI=1S/C13H18O4/c1-3-4-5-6-9-7-10(14)8-11(15)12(9)13(16)17-2/h7-8,14-15H,3-6H2,1-2H3