O1,O1-ditert-butyl O2-ethyl 4-phenylbutane-1,1,2-tricarboxylate

Systemtic Name: O1,O1-ditert-butyl O2-ethyl 4-phenylbutane-1,1,2-tricarboxylate Openeye Name: O1,O1-ditert-butyl O2-ethyl 4-phenylbutane-1,1,2-tricarboxylate CAS Name: 4-phenylbutane-1,1,2-tricarboxylic acid O1,O1-ditert-butyl ester O2-ethyl ester IUPAC Name: 1-O,1-O-ditert-butyl 2-O-ethyl 4-phenylbutane-1,1,2-tricarboxylate Traditional Name: 4-phenylbutane-1,1,2-tricarboxylic acid O1,O1-ditert-butyl ester O2-ethyl ester Formula: C23H34O6 MolecularWeight: 406.51246

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(CCC1=CC=CC=C1)C(C(=O)OC(C)(C)C)C(=O)OC(C)(C)C

Isomeric SMILES

CCOC(=O)C(CCC1=CC=CC=C1)C(C(=O)OC(C)(C)C)C(=O)OC(C)(C)C

InChI

InChI=1S/C23H34O6/c1-8-27-19(24)17(15-14-16-12-10-9-11-13-16)18(20(25)28-22(2,3)4)21(26)29-23(5,6)7/h9-13,17-18H,8,14-15H2,1-7H3