[(2S,3S)-2-(2-nitrophenyl)-4-oxidanylidene-azetidin-3-yl] benzoate

Systemtic Name: [(2S,3S)-2-(2-nitrophenyl)-4-oxidanylidene-azetidin-3-yl] benzoate Openeye Name: [(2S,3S)-2-(2-nitrophenyl)-4-oxo-azetidin-3-yl] benzoate CAS Name: benzoic acid [(2S,3S)-2-(2-nitrophenyl)-4-oxo-3-azetidinyl] ester IUPAC Name: [(2S,3S)-2-(2-nitrophenyl)-4-oxoazetidin-3-yl] benzoate Traditional Name: benzoic acid [(3S,4S)-2-keto-4-(2-nitrophenyl)azetidin-3-yl] ester Formula: C16H12N2O5 MolecularWeight: 312.27688

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C(=O)OC2C(NC2=O)C3=CC=CC=C3[N+](=O)[O-]

Isomeric SMILES

C1=CC=C(C=C1)C(=O)O[C@H]2[C@@H](NC2=O)C3=CC=CC=C3[N+](=O)[O-]

InChI

InChI=1S/C16H12N2O5/c19-15-14(23-16(20)10-6-2-1-3-7-10)13(17-15)11-8-4-5-9-12(11)18(21)22/h1-9,13-14H,(H,17,19)/t13-,14-/m0/s1