[(3S,4R)-1-(4-methoxy-2-nitro-phenyl)-2-oxidanylidene-4-phenyl-azetidin-3-yl] ethanoate

Systemtic Name: [(3S,4R)-1-(4-methoxy-2-nitro-phenyl)-2-oxidanylidene-4-phenyl-azetidin-3-yl] ethanoate Openeye Name: [(3S,4R)-1-(4-methoxy-2-nitro-phenyl)-2-oxo-4-phenyl-azetidin-3-yl] acetate CAS Name: acetic acid [(3S,4R)-1-(4-methoxy-2-nitrophenyl)-2-oxo-4-phenyl-3-azetidinyl] ester IUPAC Name: [(3S,4R)-1-(4-methoxy-2-nitrophenyl)-2-oxo-4-phenylazetidin-3-yl] acetate Traditional Name: acetic acid [(3S,4R)-2-keto-1-(4-methoxy-2-nitro-phenyl)-4-phenyl-azetidin-3-yl] ester Formula: C18H16N2O6 MolecularWeight: 356.32944

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)OC1C(N(C1=O)C2=C(C=C(C=C2)OC)[N+](=O)[O-])C3=CC=CC=C3

Isomeric SMILES

CC(=O)O[C@H]1[C@H](N(C1=O)C2=C(C=C(C=C2)OC)[N+](=O)[O-])C3=CC=CC=C3

InChI

InChI=1S/C18H16N2O6/c1-11(21)26-17-16(12-6-4-3-5-7-12)19(18(17)22)14-9-8-13(25-2)10-15(14)20(23)24/h3-10,16-17H,1-2H3/t16-,17+/m1/s1