(2-nitrophenyl)methyl [(4-oxidanylidene-3-phenacyl-azetidin-2-yl)methyl-triphenyl-$l^{5}-phosphanyl]methanoate

Systemtic Name: (2-nitrophenyl)methyl [(4-oxidanylidene-3-phenacyl-azetidin-2-yl)methyl-triphenyl-$l^{5}-phosphanyl]methanoate Openeye Name: (2-nitrophenyl)methyl [(4-oxo-3-phenacyl-azetidin-2-yl)methyl-triphenyl-$l^{5}-phosphanyl]formate CAS Name: [(4-oxo-3-phenacyl-2-azetidinyl)methyl-triphenylphosphoranyl]formic acid (2-nitrophenyl)methyl ester IUPAC Name: (2-nitrophenyl)methyl [(4-oxo-3-phenacylazetidin-2-yl)methyl-triphenyl-$l^{5}-phosphanyl]formate Traditional Name: [(4-keto-3-phenacyl-azetidin-2-yl)methyl-triphenyl-phosphoranyl]formic acid (2-nitrobenzyl) ester Formula: C38H33N2O6P MolecularWeight: 644.652181

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C(=O)CC2C(NC2=O)CP(C3=CC=CC=C3)(C4=CC=CC=C4)(C5=CC=CC=C5)C(=O)OCC6=CC=CC=C6[N+](=O)[O-]

Isomeric SMILES

C1=CC=C(C=C1)C(=O)CC2C(NC2=O)CP(C3=CC=CC=C3)(C4=CC=CC=C4)(C5=CC=CC=C5)C(=O)OCC6=CC=CC=C6[N+](=O)[O-]

InChI

InChI=1S/C38H33N2O6P/c41-36(28-15-5-1-6-16-28)25-33-34(39-37(33)42)27-47(30-18-7-2-8-19-30,31-20-9-3-10-21-31,32-22-11-4-12-23-32)38(43)46-26-29-17-13-14-24-35(29)40(44)45/h1-24,33-34H,25-27H2,(H,39,42)