N-[(1E,2S)-1-diphenylphosphorylimino-3-methyl-1-phenyl-butan-2-yl]-4-fluoranyl-benzamide

Systemtic Name: N-[(1E,2S)-1-diphenylphosphorylimino-3-methyl-1-phenyl-butan-2-yl]-4-fluoranyl-benzamide Openeye Name: N-[(1S)-1-[(E)-N-diphenylphosphoryl-C-phenyl-carbonimidoyl]-2-methyl-propyl]-4-fluoro-benzamide CAS Name: N-[(1E,2S)-1-diphenylphosphorylimino-3-methyl-1-phenylbutan-2-yl]-4-fluorobenzamide IUPAC Name: N-[(1E,2S)-1-diphenylphosphorylimino-3-methyl-1-phenylbutan-2-yl]-4-fluorobenzamide Traditional Name: N-[(1S)-1-[(E)-N-diphenylphosphoryl-C-phenyl-carbonimidoyl]-2-methyl-propyl]-4-fluoro-benzamide Formula: C30H28FN2O2P MolecularWeight: 498.527684

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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=CC=C3)NC(=O)C4=CC=C(C=C4)F

Isomeric SMILES

CC(C)[C@@H](/C(=N/P(=O)(C1=CC=CC=C1)C2=CC=CC=C2)/C3=CC=CC=C3)NC(=O)C4=CC=C(C=C4)F

InChI

InChI=1S/C30H28FN2O2P/c1-22(2)28(32-30(34)24-18-20-25(31)21-19-24)29(23-12-6-3-7-13-23)33-36(35,26-14-8-4-9-15-26)27-16-10-5-11-17-27/h3-22,28H,1-2H3,(H,32,34)/b33-29+/t28-/m0/s1