N-[1-bis(phenylmethoxy)phosphoryl-1-oxidanyl-3-(4-phenylphenyl)propan-2-yl]quinoline-3-carboxamide

Systemtic Name: N-[1-bis(phenylmethoxy)phosphoryl-1-oxidanyl-3-(4-phenylphenyl)propan-2-yl]quinoline-3-carboxamide Openeye Name: N-[2-dibenzyloxyphosphoryl-2-hydroxy-1-[(4-phenylphenyl)methyl]ethyl]quinoline-3-carboxamide CAS Name: N-[1-bis(phenylmethoxy)phosphoryl-1-hydroxy-3-(4-phenylphenyl)propan-2-yl]-3-quinolinecarboxamide IUPAC Name: N-[1-bis(phenylmethoxy)phosphoryl-1-hydroxy-3-(4-phenylphenyl)propan-2-yl]quinoline-3-carboxamide Traditional Name: N-[2-dibenzoxyphosphoryl-2-hydroxy-1-(4-phenylbenzyl)ethyl]quinoline-3-carboxamide Formula: C39H35N2O5P MolecularWeight: 642.679361

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)COP(=O)(C(C(CC2=CC=C(C=C2)C3=CC=CC=C3)NC(=O)C4=CC5=CC=CC=C5N=C4)O)OCC6=CC=CC=C6

Isomeric SMILES

C1=CC=C(C=C1)COP(=O)(C(C(CC2=CC=C(C=C2)C3=CC=CC=C3)NC(=O)C4=CC5=CC=CC=C5N=C4)O)OCC6=CC=CC=C6

InChI

InChI=1S/C39H35N2O5P/c42-38(35-25-34-18-10-11-19-36(34)40-26-35)41-37(24-29-20-22-33(23-21-29)32-16-8-3-9-17-32)39(43)47(44,45-27-30-12-4-1-5-13-30)46-28-31-14-6-2-7-15-31/h1-23,25-26,37,39,43H,24,27-28H2,(H,41,42)