[2-[(2-chloranyl-4-nitro-phenyl)amino]-2-oxidanylidene-ethyl] 3-[3-(4-fluorophenyl)-1,2,4-oxadiazol-5-yl]propanoate

Systemtic Name: [2-[(2-chloranyl-4-nitro-phenyl)amino]-2-oxidanylidene-ethyl] 3-[3-(4-fluorophenyl)-1,2,4-oxadiazol-5-yl]propanoate Openeye Name: [2-(2-chloro-4-nitro-anilino)-2-oxo-ethyl] 3-[3-(4-fluorophenyl)-1,2,4-oxadiazol-5-yl]propanoate CAS Name: 3-[3-(4-fluorophenyl)-1,2,4-oxadiazol-5-yl]propanoic acid [2-(2-chloro-4-nitroanilino)-2-oxoethyl] ester IUPAC Name: [2-(2-chloro-4-nitroanilino)-2-oxoethyl] 3-[3-(4-fluorophenyl)-1,2,4-oxadiazol-5-yl]propanoate Traditional Name: 3-[3-(4-fluorophenyl)-1,2,4-oxadiazol-5-yl]propionic acid [2-(2-chloro-4-nitro-anilino)-2-keto-ethyl] ester Formula: C19H14ClFN4O6 MolecularWeight: 448.789063

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1C2=NOC(=N2)CCC(=O)OCC(=O)NC3=C(C=C(C=C3)[N+](=O)[O-])Cl)F

Isomeric SMILES

C1=CC(=CC=C1C2=NOC(=N2)CCC(=O)OCC(=O)NC3=C(C=C(C=C3)[N+](=O)[O-])Cl)F

InChI

InChI=1S/C19H14ClFN4O6/c20-14-9-13(25(28)29)5-6-15(14)22-16(26)10-30-18(27)8-7-17-23-19(24-31-17)11-1-3-12(21)4-2-11/h1-6,9H,7-8,10H2,(H,22,26)