(2-chloranyl-4-nitro-phenyl) 3-[3-(4-methoxyphenyl)-1,2,4-oxadiazol-5-yl]propanoate

Systemtic Name: (2-chloranyl-4-nitro-phenyl) 3-[3-(4-methoxyphenyl)-1,2,4-oxadiazol-5-yl]propanoate Openeye Name: (2-chloro-4-nitro-phenyl) 3-[3-(4-methoxyphenyl)-1,2,4-oxadiazol-5-yl]propanoate CAS Name: 3-[3-(4-methoxyphenyl)-1,2,4-oxadiazol-5-yl]propanoic acid (2-chloro-4-nitrophenyl) ester IUPAC Name: (2-chloro-4-nitrophenyl) 3-[3-(4-methoxyphenyl)-1,2,4-oxadiazol-5-yl]propanoate Traditional Name: 3-[3-(4-methoxyphenyl)-1,2,4-oxadiazol-5-yl]propionic acid (2-chloro-4-nitro-phenyl) ester Formula: C18H14ClN3O6 MolecularWeight: 403.77326

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C2=NOC(=N2)CCC(=O)OC3=C(C=C(C=C3)[N+](=O)[O-])Cl

Isomeric SMILES

COC1=CC=C(C=C1)C2=NOC(=N2)CCC(=O)OC3=C(C=C(C=C3)[N+](=O)[O-])Cl

InChI

InChI=1S/C18H14ClN3O6/c1-26-13-5-2-11(3-6-13)18-20-16(28-21-18)8-9-17(23)27-15-7-4-12(22(24)25)10-14(15)19/h2-7,10H,8-9H2,1H3