tert-butyl 6-[[4-(4-acetyloxyphenyl)phenoxy]methyl]-3-chloranyl-2-oxidanyl-benzoate

Systemtic Name: tert-butyl 6-[[4-(4-acetyloxyphenyl)phenoxy]methyl]-3-chloranyl-2-oxidanyl-benzoate Openeye Name: tert-butyl 6-[[4-(4-acetoxyphenyl)phenoxy]methyl]-3-chloro-2-hydroxy-benzoate CAS Name: 6-[[4-(4-acetyloxyphenyl)phenoxy]methyl]-3-chloro-2-hydroxybenzoic acid tert-butyl ester IUPAC Name: tert-butyl 6-[[4-(4-acetyloxyphenyl)phenoxy]methyl]-3-chloro-2-hydroxybenzoate Traditional Name: 6-[[4-(4-acetoxyphenyl)phenoxy]methyl]-3-chloro-2-hydroxy-benzoic acid tert-butyl ester Formula: C26H25ClO6 MolecularWeight: 468.9261

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)OC1=CC=C(C=C1)C2=CC=C(C=C2)OCC3=C(C(=C(C=C3)Cl)O)C(=O)OC(C)(C)C

Isomeric SMILES

CC(=O)OC1=CC=C(C=C1)C2=CC=C(C=C2)OCC3=C(C(=C(C=C3)Cl)O)C(=O)OC(C)(C)C

InChI

InChI=1S/C26H25ClO6/c1-16(28)32-21-12-7-18(8-13-21)17-5-10-20(11-6-17)31-15-19-9-14-22(27)24(29)23(19)25(30)33-26(2,3)4/h5-14,29H,15H2,1-4H3