[(E)-(3-dimorpholin-4-ylphosphoryl-2-morpholin-4-yl-cyclopent-2-en-1-ylidene)-phenyl-methyl] benzoate

Systemtic Name: [(E)-(3-dimorpholin-4-ylphosphoryl-2-morpholin-4-yl-cyclopent-2-en-1-ylidene)-phenyl-methyl] benzoate Openeye Name: [(E)-(3-dimorpholinophosphoryl-2-morpholino-cyclopent-2-en-1-ylidene)-phenyl-methyl] benzoate CAS Name: benzoic acid [(E)-[3-[bis(4-morpholinyl)phosphoryl]-2-(4-morpholinyl)-1-cyclopent-2-enylidene]-phenylmethyl] ester IUPAC Name: [(E)-(3-dimorpholin-4-ylphosphoryl-2-morpholin-4-ylcyclopent-2-en-1-ylidene)-phenylmethyl] benzoate Traditional Name: benzoic acid [(E)-(3-dimorpholinophosphoryl-2-morpholino-cyclopent-2-en-1-ylidene)-phenyl-methyl] ester Formula: C31H38N3O6P MolecularWeight: 579.623681

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(=C(C2=CC=CC=C2)OC(=O)C3=CC=CC=C3)C(=C1P(=O)(N4CCOCC4)N5CCOCC5)N6CCOCC6

Isomeric SMILES

C1C/C(=C(/C2=CC=CC=C2)\OC(=O)C3=CC=CC=C3)/C(=C1P(=O)(N4CCOCC4)N5CCOCC5)N6CCOCC6

InChI

InChI=1S/C31H38N3O6P/c35-31(26-9-5-2-6-10-26)40-30(25-7-3-1-4-8-25)27-11-12-28(29(27)32-13-19-37-20-14-32)41(36,33-15-21-38-22-16-33)34-17-23-39-24-18-34/h1-10H,11-24H2/b30-27+