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

Systemtic Name: tert-butyl 1-[2-fluoranyl-4-(phenylmethoxycarbonylamino)phenyl]cyclopropane-1-carboxylate Openeye Name: tert-butyl 1-[4-(benzyloxycarbonylamino)-2-fluoro-phenyl]cyclopropanecarboxylate CAS Name: 1-[2-fluoro-4-(phenylmethoxycarbonylamino)phenyl]-1-cyclopropanecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl 1-[2-fluoro-4-(phenylmethoxycarbonylamino)phenyl]cyclopropane-1-carboxylate Traditional Name: 1-[4-(benzyloxycarbonylamino)-2-fluoro-phenyl]cyclopropanecarboxylic acid tert-butyl ester Formula: C22H24FNO4 MolecularWeight: 385.428663

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C22H24FNO4/c1-21(2,3)28-19(25)22(11-12-22)17-10-9-16(13-18(17)23)24-20(26)27-14-15-7-5-4-6-8-15/h4-10,13H,11-12,14H2,1-3H3,(H,24,26)