[2-oxidanylidene-2-[(2,4,6-trimethylphenyl)amino]ethyl] 1-diphenylphosphorylcyclopropane-1-carboxylate

Systemtic Name: [2-oxidanylidene-2-[(2,4,6-trimethylphenyl)amino]ethyl] 1-diphenylphosphorylcyclopropane-1-carboxylate Openeye Name: [2-oxo-2-(2,4,6-trimethylanilino)ethyl] 1-diphenylphosphorylcyclopropanecarboxylate CAS Name: 1-diphenylphosphoryl-1-cyclopropanecarboxylic acid [2-oxo-2-(2,4,6-trimethylanilino)ethyl] ester IUPAC Name: [2-oxo-2-(2,4,6-trimethylanilino)ethyl] 1-diphenylphosphorylcyclopropane-1-carboxylate Traditional Name: 1-diphenylphosphorylcyclopropanecarboxylic acid (2-keto-2-mesidino-ethyl) ester Formula: C27H28NO4P MolecularWeight: 461.489281

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C(=C1)C)NC(=O)COC(=O)C2(CC2)P(=O)(C3=CC=CC=C3)C4=CC=CC=C4)C

Isomeric SMILES

CC1=CC(=C(C(=C1)C)NC(=O)COC(=O)C2(CC2)P(=O)(C3=CC=CC=C3)C4=CC=CC=C4)C

InChI

InChI=1S/C27H28NO4P/c1-19-16-20(2)25(21(3)17-19)28-24(29)18-32-26(30)27(14-15-27)33(31,22-10-6-4-7-11-22)23-12-8-5-9-13-23/h4-13,16-17H,14-15,18H2,1-3H3,(H,28,29)