[2-oxidanylidene-2-[[2-(phenylmethyl)phenyl]amino]ethyl] 1-diphenylphosphorylcyclopropane-1-carboxylate

Systemtic Name: [2-oxidanylidene-2-[[2-(phenylmethyl)phenyl]amino]ethyl] 1-diphenylphosphorylcyclopropane-1-carboxylate Openeye Name: [2-(2-benzylanilino)-2-oxo-ethyl] 1-diphenylphosphorylcyclopropanecarboxylate CAS Name: 1-diphenylphosphoryl-1-cyclopropanecarboxylic acid [2-oxo-2-[2-(phenylmethyl)anilino]ethyl] ester IUPAC Name: [2-(2-benzylanilino)-2-oxoethyl] 1-diphenylphosphorylcyclopropane-1-carboxylate Traditional Name: 1-diphenylphosphorylcyclopropanecarboxylic acid [2-(2-benzylanilino)-2-keto-ethyl] ester Formula: C31H28NO4P MolecularWeight: 509.532081

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Descriptors Computed from Structure

Canonical SMILES:

C1CC1(C(=O)OCC(=O)NC2=CC=CC=C2CC3=CC=CC=C3)P(=O)(C4=CC=CC=C4)C5=CC=CC=C5

Isomeric SMILES

C1CC1(C(=O)OCC(=O)NC2=CC=CC=C2CC3=CC=CC=C3)P(=O)(C4=CC=CC=C4)C5=CC=CC=C5

InChI

InChI=1S/C31H28NO4P/c33-29(32-28-19-11-10-14-25(28)22-24-12-4-1-5-13-24)23-36-30(34)31(20-21-31)37(35,26-15-6-2-7-16-26)27-17-8-3-9-18-27/h1-19H,20-23H2,(H,32,33)