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

Systemtic Name: (4-butan-2-ylphenyl)methyl 3,4-bis(oxidanyl)benzoate Openeye Name: (4-sec-butylphenyl)methyl 3,4-dihydroxybenzoate CAS Name: 3,4-dihydroxybenzoic acid (4-butan-2-ylphenyl)methyl ester IUPAC Name: (4-butan-2-ylphenyl)methyl 3,4-dihydroxybenzoate Traditional Name: 3,4-dihydroxybenzoic acid (4-sec-butylbenzyl) ester Formula: C18H20O4 MolecularWeight: 300.349

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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

Isomeric SMILES

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

InChI

InChI=1S/C18H20O4/c1-3-12(2)14-6-4-13(5-7-14)11-22-18(21)15-8-9-16(19)17(20)10-15/h4-10,12,19-20H,3,11H2,1-2H3