(4-butan-2-ylphenyl)methyl 3,4,5-tris(oxidanyl)benzoate

Systemtic Name: (4-butan-2-ylphenyl)methyl 3,4,5-tris(oxidanyl)benzoate Openeye Name: (4-sec-butylphenyl)methyl 3,4,5-trihydroxybenzoate CAS Name: 3,4,5-trihydroxybenzoic acid (4-butan-2-ylphenyl)methyl ester IUPAC Name: (4-butan-2-ylphenyl)methyl 3,4,5-trihydroxybenzoate Traditional Name: 3,4,5-trihydroxybenzoic acid (4-sec-butylbenzyl) ester Formula: C18H20O5 MolecularWeight: 316.3484

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)C1=CC=C(C=C1)COC(=O)C2=CC(=C(C(=C2)O)O)O

Isomeric SMILES

CCC(C)C1=CC=C(C=C1)COC(=O)C2=CC(=C(C(=C2)O)O)O

InChI

InChI=1S/C18H20O5/c1-3-11(2)13-6-4-12(5-7-13)10-23-18(22)14-8-15(19)17(21)16(20)9-14/h4-9,11,19-21H,3,10H2,1-2H3