(phenylmethyl) N-[(4-cyanophenyl)-diphenoxyphosphoryl-methyl]carbamate

Systemtic Name: (phenylmethyl) N-[(4-cyanophenyl)-diphenoxyphosphoryl-methyl]carbamate Openeye Name: benzyl N-[(4-cyanophenyl)-diphenoxyphosphoryl-methyl]carbamate CAS Name: N-[(4-cyanophenyl)-diphenoxyphosphorylmethyl]carbamic acid (phenylmethyl) ester IUPAC Name: benzyl N-[(4-cyanophenyl)-diphenoxyphosphorylmethyl]carbamate Traditional Name: N-[(4-cyanophenyl)-diphenoxyphosphoryl-methyl]carbamic acid benzyl ester Formula: C28H23N2O5P MolecularWeight: 498.466381

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)COC(=O)NC(C2=CC=C(C=C2)C#N)P(=O)(OC3=CC=CC=C3)OC4=CC=CC=C4

Isomeric SMILES

C1=CC=C(C=C1)COC(=O)NC(C2=CC=C(C=C2)C#N)P(=O)(OC3=CC=CC=C3)OC4=CC=CC=C4

InChI

InChI=1S/C28H23N2O5P/c29-20-22-16-18-24(19-17-22)27(30-28(31)33-21-23-10-4-1-5-11-23)36(32,34-25-12-6-2-7-13-25)35-26-14-8-3-9-15-26/h1-19,27H,21H2,(H,30,31)