ditert-butyl (2E)-2-phenethylidenepentanedioate

Systemtic Name: ditert-butyl (2E)-2-phenethylidenepentanedioate Openeye Name: ditert-butyl (2E)-2-phenethylidenepentanedioate CAS Name: (2E)-2-phenethylidenepentanedioic acid ditert-butyl ester IUPAC Name: ditert-butyl (2E)-2-phenethylidenepentanedioate Traditional Name: (2E)-2-phenethylideneglutaric acid ditert-butyl ester Formula: C21H30O4 MolecularWeight: 346.4605

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

CC(C)(C)OC(=O)CC/C(=C\CC1=CC=CC=C1)/C(=O)OC(C)(C)C

InChI

InChI=1S/C21H30O4/c1-20(2,3)24-18(22)15-14-17(19(23)25-21(4,5)6)13-12-16-10-8-7-9-11-16/h7-11,13H,12,14-15H2,1-6H3/b17-13+