(2,4-ditert-butyl-6-chloranyl-phenyl) benzoate

Systemtic Name: (2,4-ditert-butyl-6-chloranyl-phenyl) benzoate Openeye Name: (2,4-ditert-butyl-6-chloro-phenyl) benzoate CAS Name: benzoic acid (2,4-ditert-butyl-6-chlorophenyl) ester IUPAC Name: (2,4-ditert-butyl-6-chlorophenyl) benzoate Traditional Name: benzoic acid (2,4-ditert-butyl-6-chloro-phenyl) ester Formula: C21H25ClO2 MolecularWeight: 344.875

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H25ClO2/c1-20(2,3)15-12-16(21(4,5)6)18(17(22)13-15)24-19(23)14-10-8-7-9-11-14/h7-13H,1-6H3