[2-[(4-cyanophenyl)amino]-2-oxidanylidene-ethyl] 1-diphenylphosphorylcyclopropane-1-carboxylate

Systemtic Name: [2-[(4-cyanophenyl)amino]-2-oxidanylidene-ethyl] 1-diphenylphosphorylcyclopropane-1-carboxylate Openeye Name: [2-(4-cyanoanilino)-2-oxo-ethyl] 1-diphenylphosphorylcyclopropanecarboxylate CAS Name: 1-diphenylphosphoryl-1-cyclopropanecarboxylic acid [2-(4-cyanoanilino)-2-oxoethyl] ester IUPAC Name: [2-(4-cyanoanilino)-2-oxoethyl] 1-diphenylphosphorylcyclopropane-1-carboxylate Traditional Name: 1-diphenylphosphorylcyclopropanecarboxylic acid [2-(4-cyanoanilino)-2-keto-ethyl] ester Formula: C25H21N2O4P MolecularWeight: 444.419001

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Descriptors Computed from Structure

Canonical SMILES:

C1CC1(C(=O)OCC(=O)NC2=CC=C(C=C2)C#N)P(=O)(C3=CC=CC=C3)C4=CC=CC=C4

Isomeric SMILES

C1CC1(C(=O)OCC(=O)NC2=CC=C(C=C2)C#N)P(=O)(C3=CC=CC=C3)C4=CC=CC=C4

InChI

InChI=1S/C25H21N2O4P/c26-17-19-11-13-20(14-12-19)27-23(28)18-31-24(29)25(15-16-25)32(30,21-7-3-1-4-8-21)22-9-5-2-6-10-22/h1-14H,15-16,18H2,(H,27,28)