ditert-butyl 2-[(4-chlorophenyl)-oxidanyl-methyl]propanedioate

Systemtic Name: ditert-butyl 2-[(4-chlorophenyl)-oxidanyl-methyl]propanedioate Openeye Name: ditert-butyl 2-[(4-chlorophenyl)-hydroxy-methyl]propanedioate CAS Name: 2-[(4-chlorophenyl)-hydroxymethyl]propanedioic acid ditert-butyl ester IUPAC Name: ditert-butyl 2-[(4-chlorophenyl)-hydroxymethyl]propanedioate Traditional Name: 2-[(4-chlorophenyl)-hydroxy-methyl]malonic acid ditert-butyl ester Formula: C18H25ClO5 MolecularWeight: 356.8411

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H25ClO5/c1-17(2,3)23-15(21)13(16(22)24-18(4,5)6)14(20)11-7-9-12(19)10-8-11/h7-10,13-14,20H,1-6H3