ditert-butyl 2-[[4-(4-acetyloxyphenyl)-2-ethyl-pentanoyl]oxymethyl]propanedioate

Systemtic Name: ditert-butyl 2-[[4-(4-acetyloxyphenyl)-2-ethyl-pentanoyl]oxymethyl]propanedioate Openeye Name: ditert-butyl 2-[[4-(4-acetoxyphenyl)-2-ethyl-pentanoyl]oxymethyl]propanedioate CAS Name: 2-[[4-(4-acetyloxyphenyl)-2-ethyl-1-oxopentoxy]methyl]propanedioic acid ditert-butyl ester IUPAC Name: ditert-butyl 2-[[4-(4-acetyloxyphenyl)-2-ethylpentanoyl]oxymethyl]propanedioate Traditional Name: 2-[[4-(4-acetoxyphenyl)-2-ethyl-pentanoyl]oxymethyl]malonic acid ditert-butyl ester Formula: C27H40O8 MolecularWeight: 492.6017

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Descriptors Computed from Structure

Canonical SMILES:

CCC(CC(C)C1=CC=C(C=C1)OC(=O)C)C(=O)OCC(C(=O)OC(C)(C)C)C(=O)OC(C)(C)C

Isomeric SMILES

CCC(CC(C)C1=CC=C(C=C1)OC(=O)C)C(=O)OCC(C(=O)OC(C)(C)C)C(=O)OC(C)(C)C

InChI

InChI=1S/C27H40O8/c1-10-19(15-17(2)20-11-13-21(14-12-20)33-18(3)28)23(29)32-16-22(24(30)34-26(4,5)6)25(31)35-27(7,8)9/h11-14,17,19,22H,10,15-16H2,1-9H3