methyl 3-(hydroxymethyl)-2,4-bis(oxidanyl)-6-propyl-benzoate

Systemtic Name: methyl 3-(hydroxymethyl)-2,4-bis(oxidanyl)-6-propyl-benzoate Openeye Name: methyl 2,4-dihydroxy-3-(hydroxymethyl)-6-propyl-benzoate CAS Name: 2,4-dihydroxy-3-(hydroxymethyl)-6-propylbenzoic acid methyl ester IUPAC Name: methyl 2,4-dihydroxy-3-(hydroxymethyl)-6-propylbenzoate Traditional Name: 2,4-dihydroxy-3-methylol-6-propyl-benzoic acid methyl ester Formula: C12H16O5 MolecularWeight: 240.25244

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=CC(=C(C(=C1C(=O)OC)O)CO)O

Isomeric SMILES

CCCC1=CC(=C(C(=C1C(=O)OC)O)CO)O

InChI

InChI=1S/C12H16O5/c1-3-4-7-5-9(14)8(6-13)11(15)10(7)12(16)17-2/h5,13-15H,3-4,6H2,1-2H3