butyl 2-(4-methyl-3-oxidanyl-phenyl)-2-oxidanyl-ethanoate

Systemtic Name: butyl 2-(4-methyl-3-oxidanyl-phenyl)-2-oxidanyl-ethanoate Openeye Name: butyl 2-hydroxy-2-(3-hydroxy-4-methyl-phenyl)acetate CAS Name: 2-hydroxy-2-(3-hydroxy-4-methylphenyl)acetic acid butyl ester IUPAC Name: butyl 2-hydroxy-2-(3-hydroxy-4-methylphenyl)acetate Traditional Name: 2-hydroxy-2-(3-hydroxy-4-methyl-phenyl)acetic acid butyl ester Formula: C13H18O4 MolecularWeight: 238.27962

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC(=O)C(C1=CC(=C(C=C1)C)O)O

Isomeric SMILES

CCCCOC(=O)C(C1=CC(=C(C=C1)C)O)O

InChI

InChI=1S/C13H18O4/c1-3-4-7-17-13(16)12(15)10-6-5-9(2)11(14)8-10/h5-6,8,12,14-15H,3-4,7H2,1-2H3