O1,O1'-ditert-butyl O3-[(4-methoxyphenyl)methyl] 4-oxidanylidenecyclohexane-1,1,3-tricarboxylate

Systemtic Name: O1,O1'-ditert-butyl O3-[(4-methoxyphenyl)methyl] 4-oxidanylidenecyclohexane-1,1,3-tricarboxylate Openeye Name: O1,O1'-ditert-butyl O3-[(4-methoxyphenyl)methyl] 4-oxocyclohexane-1,1,3-tricarboxylate CAS Name: 4-oxocyclohexane-1,1,3-tricarboxylic acid O1,O1'-ditert-butyl ester O3-[(4-methoxyphenyl)methyl] ester IUPAC Name: 1-O,1-O'-ditert-butyl 3-O-[(4-methoxyphenyl)methyl] 4-oxocyclohexane-1,1,3-tricarboxylate Traditional Name: 4-ketocyclohexane-1,1,3-tricarboxylic acid O1,O1'-ditert-butyl ester O3-p-anisyl ester Formula: C25H34O8 MolecularWeight: 462.53266

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)C1(CCC(=O)C(C1)C(=O)OCC2=CC=C(C=C2)OC)C(=O)OC(C)(C)C

Isomeric SMILES

CC(C)(C)OC(=O)C1(CCC(=O)C(C1)C(=O)OCC2=CC=C(C=C2)OC)C(=O)OC(C)(C)C

InChI

InChI=1S/C25H34O8/c1-23(2,3)32-21(28)25(22(29)33-24(4,5)6)13-12-19(26)18(14-25)20(27)31-15-16-8-10-17(30-7)11-9-16/h8-11,18H,12-15H2,1-7H3