bis[(4-nitrophenyl)methyl] 2-[(4-oxidanylideneazetidin-2-yl)-phenylmethoxycarbonyl-amino]propanedioate

Systemtic Name: bis[(4-nitrophenyl)methyl] 2-[(4-oxidanylideneazetidin-2-yl)-phenylmethoxycarbonyl-amino]propanedioate Openeye Name: bis[(4-nitrophenyl)methyl] 2-[benzyloxycarbonyl-(4-oxoazetidin-2-yl)amino]propanedioate CAS Name: 2-[(4-oxo-2-azetidinyl)-phenylmethoxycarbonylamino]propanedioic acid bis[(4-nitrophenyl)methyl] ester IUPAC Name: bis[(4-nitrophenyl)methyl] 2-[(4-oxoazetidin-2-yl)-phenylmethoxycarbonylamino]propanedioate Traditional Name: 2-[carbobenzoxy-(4-ketoazetidin-2-yl)amino]malonic acid bis(4-nitrobenzyl) ester Formula: C28H24N4O11 MolecularWeight: 592.51036

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Descriptors Computed from Structure

Canonical SMILES:

C1C(NC1=O)N(C(C(=O)OCC2=CC=C(C=C2)[N+](=O)[O-])C(=O)OCC3=CC=C(C=C3)[N+](=O)[O-])C(=O)OCC4=CC=CC=C4

Isomeric SMILES

C1C(NC1=O)N(C(C(=O)OCC2=CC=C(C=C2)[N+](=O)[O-])C(=O)OCC3=CC=C(C=C3)[N+](=O)[O-])C(=O)OCC4=CC=CC=C4

InChI

InChI=1S/C28H24N4O11/c33-24-14-23(29-24)30(28(36)43-17-18-4-2-1-3-5-18)25(26(34)41-15-19-6-10-21(11-7-19)31(37)38)27(35)42-16-20-8-12-22(13-9-20)32(39)40/h1-13,23,25H,14-17H2,(H,29,33)