methyl 4-tert-butylbenzoate

Systemtic Name: methyl 4-tert-butylbenzoate Openeye Name: methyl 4-tert-butylbenzoate CAS Name: 4-tert-butylbenzoic acid methyl ester IUPAC Name: methyl 4-tert-butylbenzoate Traditional Name: 4-tert-butylbenzoic acid methyl ester Formula: C12H16O2 MolecularWeight: 192.25424

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C12H16O2/c1-12(2,3)10-7-5-9(6-8-10)11(13)14-4/h5-8H,1-4H3