tert-butyl 1-[2,6-bis(fluoranyl)-4-(phenylmethoxycarbonylamino)phenyl]cyclopropane-1-carboxylate

Systemtic Name: tert-butyl 1-[2,6-bis(fluoranyl)-4-(phenylmethoxycarbonylamino)phenyl]cyclopropane-1-carboxylate Openeye Name: tert-butyl 1-[4-(benzyloxycarbonylamino)-2,6-difluoro-phenyl]cyclopropanecarboxylate CAS Name: 1-[2,6-difluoro-4-(phenylmethoxycarbonylamino)phenyl]-1-cyclopropanecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl 1-[2,6-difluoro-4-(phenylmethoxycarbonylamino)phenyl]cyclopropane-1-carboxylate Traditional Name: 1-[4-(benzyloxycarbonylamino)-2,6-difluoro-phenyl]cyclopropanecarboxylic acid tert-butyl ester Formula: C22H23F2NO4 MolecularWeight: 403.419126

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)C1(CC1)C2=C(C=C(C=C2F)NC(=O)OCC3=CC=CC=C3)F

Isomeric SMILES

CC(C)(C)OC(=O)C1(CC1)C2=C(C=C(C=C2F)NC(=O)OCC3=CC=CC=C3)F

InChI

InChI=1S/C22H23F2NO4/c1-21(2,3)29-19(26)22(9-10-22)18-16(23)11-15(12-17(18)24)25-20(27)28-13-14-7-5-4-6-8-14/h4-8,11-12H,9-10,13H2,1-3H3,(H,25,27)