(4-chloranyl-5-methyl-2-propan-2-yl-phenyl) 4-tert-butylbenzoate

Systemtic Name: (4-chloranyl-5-methyl-2-propan-2-yl-phenyl) 4-tert-butylbenzoate Openeye Name: (4-chloro-2-isopropyl-5-methyl-phenyl) 4-tert-butylbenzoate CAS Name: 4-tert-butylbenzoic acid (4-chloro-5-methyl-2-propan-2-ylphenyl) ester IUPAC Name: (4-chloro-5-methyl-2-propan-2-ylphenyl) 4-tert-butylbenzoate Traditional Name: 4-tert-butylbenzoic acid (4-chloro-2-isopropyl-5-methyl-phenyl) ester Formula: C21H25ClO2 MolecularWeight: 344.875

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1Cl)C(C)C)OC(=O)C2=CC=C(C=C2)C(C)(C)C

Isomeric SMILES

CC1=CC(=C(C=C1Cl)C(C)C)OC(=O)C2=CC=C(C=C2)C(C)(C)C

InChI

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