[2-[(3-cyanophenyl)amino]-2-oxidanylidene-ethyl] 1-diphenylphosphorylcyclopropane-1-carboxylate

Systemtic Name: [2-[(3-cyanophenyl)amino]-2-oxidanylidene-ethyl] 1-diphenylphosphorylcyclopropane-1-carboxylate Openeye Name: [2-(3-cyanoanilino)-2-oxo-ethyl] 1-diphenylphosphorylcyclopropanecarboxylate CAS Name: 1-diphenylphosphoryl-1-cyclopropanecarboxylic acid [2-(3-cyanoanilino)-2-oxoethyl] ester IUPAC Name: [2-(3-cyanoanilino)-2-oxoethyl] 1-diphenylphosphorylcyclopropane-1-carboxylate Traditional Name: 1-diphenylphosphorylcyclopropanecarboxylic acid [2-(3-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=CC(=C2)C#N)P(=O)(C3=CC=CC=C3)C4=CC=CC=C4

Isomeric SMILES

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

InChI

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