(4-chloranyl-3-methyl-phenyl) 3,5-ditert-butylbenzoate

Systemtic Name: (4-chloranyl-3-methyl-phenyl) 3,5-ditert-butylbenzoate Openeye Name: (4-chloro-3-methyl-phenyl) 3,5-ditert-butylbenzoate CAS Name: 3,5-ditert-butylbenzoic acid (4-chloro-3-methylphenyl) ester IUPAC Name: (4-chloro-3-methylphenyl) 3,5-ditert-butylbenzoate Traditional Name: 3,5-ditert-butylbenzoic acid (4-chloro-3-methyl-phenyl) ester Formula: C22H27ClO2 MolecularWeight: 358.90158

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C22H27ClO2/c1-14-10-18(8-9-19(14)23)25-20(24)15-11-16(21(2,3)4)13-17(12-15)22(5,6)7/h8-13H,1-7H3