ditert-butyl 3-fluoranylbenzene-1,2-dicarboxylate

Systemtic Name: ditert-butyl 3-fluoranylbenzene-1,2-dicarboxylate Openeye Name: ditert-butyl 3-fluorobenzene-1,2-dicarboxylate CAS Name: 3-fluorobenzene-1,2-dicarboxylic acid ditert-butyl ester IUPAC Name: ditert-butyl 3-fluorobenzene-1,2-dicarboxylate Traditional Name: 3-fluorobenzene-1,2-dicarboxylic acid ditert-butyl ester Formula: C16H21FO4 MolecularWeight: 296.333943

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)C1=C(C(=CC=C1)F)C(=O)OC(C)(C)C

Isomeric SMILES

CC(C)(C)OC(=O)C1=C(C(=CC=C1)F)C(=O)OC(C)(C)C

InChI

InChI=1S/C16H21FO4/c1-15(2,3)20-13(18)10-8-7-9-11(17)12(10)14(19)21-16(4,5)6/h7-9H,1-6H3