methyl 4-butyl-3-oxidanyl-benzoate

Systemtic Name: methyl 4-butyl-3-oxidanyl-benzoate Openeye Name: methyl 4-butyl-3-hydroxy-benzoate CAS Name: 4-butyl-3-hydroxybenzoic acid methyl ester IUPAC Name: methyl 4-butyl-3-hydroxybenzoate Traditional Name: 4-butyl-3-hydroxy-benzoic acid methyl ester Formula: C12H16O3 MolecularWeight: 208.25364

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=C(C=C(C=C1)C(=O)OC)O

Isomeric SMILES

CCCCC1=C(C=C(C=C1)C(=O)OC)O

InChI

InChI=1S/C12H16O3/c1-3-4-5-9-6-7-10(8-11(9)13)12(14)15-2/h6-8,13H,3-5H2,1-2H3