2-[3-(4-chloranylphenoxy)-2-(2-nitrophenyl)-4-oxidanylidene-azetidin-1-yl]propanoic acid

Systemtic Name: 2-[3-(4-chloranylphenoxy)-2-(2-nitrophenyl)-4-oxidanylidene-azetidin-1-yl]propanoic acid Openeye Name: 2-[3-(4-chlorophenoxy)-2-(2-nitrophenyl)-4-oxo-azetidin-1-yl]propanoic acid CAS Name: 2-[3-(4-chlorophenoxy)-2-(2-nitrophenyl)-4-oxo-1-azetidinyl]propanoic acid IUPAC Name: 2-[3-(4-chlorophenoxy)-2-(2-nitrophenyl)-4-oxoazetidin-1-yl]propanoic acid Traditional Name: 2-[3-(4-chlorophenoxy)-2-keto-4-(2-nitrophenyl)azetidin-1-yl]propionic acid Formula: C18H15ClN2O6 MolecularWeight: 390.7745

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)O)N1C(C(C1=O)OC2=CC=C(C=C2)Cl)C3=CC=CC=C3[N+](=O)[O-]

Isomeric SMILES

CC(C(=O)O)N1C(C(C1=O)OC2=CC=C(C=C2)Cl)C3=CC=CC=C3[N+](=O)[O-]

InChI

InChI=1S/C18H15ClN2O6/c1-10(18(23)24)20-15(13-4-2-3-5-14(13)21(25)26)16(17(20)22)27-12-8-6-11(19)7-9-12/h2-10,15-16H,1H3,(H,23,24)