tert-butyl N-[(1E,2S)-1-diphenylphosphorylimino-1-(4-fluorophenyl)-3-methyl-butan-2-yl]carbamate

Systemtic Name: tert-butyl N-[(1E,2S)-1-diphenylphosphorylimino-1-(4-fluorophenyl)-3-methyl-butan-2-yl]carbamate Openeye Name: tert-butyl N-[(1S)-1-[(E)-N-diphenylphosphoryl-C-(4-fluorophenyl)carbonimidoyl]-2-methyl-propyl]carbamate CAS Name: N-[(1E,2S)-1-diphenylphosphorylimino-1-(4-fluorophenyl)-3-methylbutan-2-yl]carbamic acid tert-butyl ester IUPAC Name: tert-butyl N-[(1E,2S)-1-diphenylphosphorylimino-1-(4-fluorophenyl)-3-methylbutan-2-yl]carbamate Traditional Name: N-[(1S)-1-[(E)-N-diphenylphosphoryl-C-(4-fluorophenyl)carbonimidoyl]-2-methyl-propyl]carbamic acid tert-butyl ester Formula: C28H32FN2O3P MolecularWeight: 494.537444

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

CC(C)[C@@H](/C(=N/P(=O)(C1=CC=CC=C1)C2=CC=CC=C2)/C3=CC=C(C=C3)F)NC(=O)OC(C)(C)C

InChI

InChI=1S/C28H32FN2O3P/c1-20(2)25(30-27(32)34-28(3,4)5)26(21-16-18-22(29)19-17-21)31-35(33,23-12-8-6-9-13-23)24-14-10-7-11-15-24/h6-20,25H,1-5H3,(H,30,32)/b31-26+/t25-/m0/s1