3-[3,4,5-tris(oxidanyl)phenyl]propyl 2-methylbutanoate

Systemtic Name: 3-[3,4,5-tris(oxidanyl)phenyl]propyl 2-methylbutanoate Openeye Name: 3-(3,4,5-trihydroxyphenyl)propyl 2-methylbutanoate CAS Name: 2-methylbutanoic acid 3-(3,4,5-trihydroxyphenyl)propyl ester IUPAC Name: 3-(3,4,5-trihydroxyphenyl)propyl 2-methylbutanoate Traditional Name: 2-methylbutyric acid 3-(3,4,5-trihydroxyphenyl)propyl ester Formula: C14H20O5 MolecularWeight: 268.3056

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)C(=O)OCCCC1=CC(=C(C(=C1)O)O)O

Isomeric SMILES

CCC(C)C(=O)OCCCC1=CC(=C(C(=C1)O)O)O

InChI

InChI=1S/C14H20O5/c1-3-9(2)14(18)19-6-4-5-10-7-11(15)13(17)12(16)8-10/h7-9,15-17H,3-6H2,1-2H3