O1,O1-ditert-butyl O3-ethyl 2-(3,4-dichlorophenyl)propane-1,1,3-tricarboxylate

Systemtic Name: O1,O1-ditert-butyl O3-ethyl 2-(3,4-dichlorophenyl)propane-1,1,3-tricarboxylate Openeye Name: O1,O1-ditert-butyl O3-ethyl 2-(3,4-dichlorophenyl)propane-1,1,3-tricarboxylate CAS Name: 2-(3,4-dichlorophenyl)propane-1,1,3-tricarboxylic acid O1,O1-ditert-butyl ester O3-ethyl ester IUPAC Name: 1-O,1-O-ditert-butyl 3-O-ethyl 2-(3,4-dichlorophenyl)propane-1,1,3-tricarboxylate Traditional Name: 2-(3,4-dichlorophenyl)propane-1,1,3-tricarboxylic acid O1,O1-ditert-butyl ester O3-ethyl ester Formula: C22H30Cl2O6 MolecularWeight: 461.376

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C22H30Cl2O6/c1-8-28-17(25)12-14(13-9-10-15(23)16(24)11-13)18(19(26)29-21(2,3)4)20(27)30-22(5,6)7/h9-11,14,18H,8,12H2,1-7H3