diphenacyl 2-methyl-2-oxidanyl-butanedioate

Systemtic Name: diphenacyl 2-methyl-2-oxidanyl-butanedioate Openeye Name: diphenacyl 2-hydroxy-2-methyl-butanedioate CAS Name: 2-hydroxy-2-methylbutanedioic acid diphenacyl ester IUPAC Name: diphenacyl 2-hydroxy-2-methylbutanedioate Traditional Name: 2-hydroxy-2-methyl-succinic acid diphenacyl ester Formula: C21H20O7 MolecularWeight: 384.3793

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H20O7/c1-21(26,20(25)28-14-18(23)16-10-6-3-7-11-16)12-19(24)27-13-17(22)15-8-4-2-5-9-15/h2-11,26H,12-14H2,1H3