methyl 3-tert-butyl-4-methoxy-benzoate

Systemtic Name: methyl 3-tert-butyl-4-methoxy-benzoate Openeye Name: methyl 3-tert-butyl-4-methoxy-benzoate CAS Name: 3-tert-butyl-4-methoxybenzoic acid methyl ester IUPAC Name: methyl 3-tert-butyl-4-methoxybenzoate Traditional Name: 3-tert-butyl-4-methoxy-benzoic acid methyl ester Formula: C13H18O3 MolecularWeight: 222.28022

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C13H18O3/c1-13(2,3)10-8-9(12(14)16-5)6-7-11(10)15-4/h6-8H,1-5H3