(5-tert-butyl-2,3-dimethyl-phenyl) benzoate

Systemtic Name: (5-tert-butyl-2,3-dimethyl-phenyl) benzoate Openeye Name: (5-tert-butyl-2,3-dimethyl-phenyl) benzoate CAS Name: benzoic acid (5-tert-butyl-2,3-dimethylphenyl) ester IUPAC Name: (5-tert-butyl-2,3-dimethylphenyl) benzoate Traditional Name: benzoic acid (5-tert-butyl-2,3-dimethyl-phenyl) ester Formula: C19H22O2 MolecularWeight: 282.37678

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=CC(=C1)C(C)(C)C)OC(=O)C2=CC=CC=C2)C

Isomeric SMILES

CC1=C(C(=CC(=C1)C(C)(C)C)OC(=O)C2=CC=CC=C2)C

InChI

InChI=1S/C19H22O2/c1-13-11-16(19(3,4)5)12-17(14(13)2)21-18(20)15-9-7-6-8-10-15/h6-12H,1-5H3