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2,2-bis[[4-(2,2-dimethylpropanoyl)phenyl]methyl]propanedioic acid

2,2-bis[[4-(2,2-dimethylpropanoyl)phenyl]methyl]propanedioic acid

Systemtic Name:2,2-bis[[4-(2,2-dimethylpropanoyl)phenyl]methyl]propanedioic acid
Openeye Name:2,2-bis[[4-(2,2-dimethylpropanoyl)phenyl]methyl]propanedioic acid
CAS Name:2,2-bis[[4-(2,2-dimethyl-1-oxopropyl)phenyl]methyl]propanedioic acid
IUPAC Name:2,2-bis[[4-(2,2-dimethylpropanoyl)phenyl]methyl]propanedioic acid
Traditional Name:2,2-bis(4-pivaloylbenzyl)malonic acid
Formula: C27H32O6
MolecularWeight: 452.53938
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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C(=O)C1=CC=C(C=C1)CC(CC2=CC=C(C=C2)C(=O)C(C)(C)C)(C(=O)O)C(=O)O


Isomeric SMILES

CC(C)(C)C(=O)C1=CC=C(C=C1)CC(CC2=CC=C(C=C2)C(=O)C(C)(C)C)(C(=O)O)C(=O)O


InChI

InChI=1S/C27H32O6/c1-25(2,3)21(28)19-11-7-17(8-12-19)15-27(23(30)31,24(32)33)16-18-9-13-20(14-10-18)22(29)26(4,5)6/h7-14H,15-16H2,1-6H3,(H,30,31)(H,32,33)


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