hexan-3-yl 3,4,5-tris(oxidanyl)benzoate

Systemtic Name: hexan-3-yl 3,4,5-tris(oxidanyl)benzoate Openeye Name: 1-ethylbutyl 3,4,5-trihydroxybenzoate CAS Name: 3,4,5-trihydroxybenzoic acid hexan-3-yl ester IUPAC Name: hexan-3-yl 3,4,5-trihydroxybenzoate Traditional Name: 3,4,5-trihydroxybenzoic acid 1-ethylbutyl ester Formula: C13H18O5 MolecularWeight: 254.27902

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(CC)OC(=O)C1=CC(=C(C(=C1)O)O)O

Isomeric SMILES

CCCC(CC)OC(=O)C1=CC(=C(C(=C1)O)O)O

InChI

InChI=1S/C13H18O5/c1-3-5-9(4-2)18-13(17)8-6-10(14)12(16)11(15)7-8/h6-7,9,14-16H,3-5H2,1-2H3