propan-2-yl 2-[5-(2-chloranyl-4-methoxy-3-nitro-phenyl)-1,3,4-oxadiazol-2-yl]benzoate

Systemtic Name: propan-2-yl 2-[5-(2-chloranyl-4-methoxy-3-nitro-phenyl)-1,3,4-oxadiazol-2-yl]benzoate Openeye Name: isopropyl 2-[5-(2-chloro-4-methoxy-3-nitro-phenyl)-1,3,4-oxadiazol-2-yl]benzoate CAS Name: 2-[5-(2-chloro-4-methoxy-3-nitrophenyl)-1,3,4-oxadiazol-2-yl]benzoic acid propan-2-yl ester IUPAC Name: propan-2-yl 2-[5-(2-chloro-4-methoxy-3-nitrophenyl)-1,3,4-oxadiazol-2-yl]benzoate Traditional Name: 2-[5-(2-chloro-4-methoxy-3-nitro-phenyl)-1,3,4-oxadiazol-2-yl]benzoic acid isopropyl ester Formula: C19H16ClN3O6 MolecularWeight: 417.79984

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)OC(=O)C1=CC=CC=C1C2=NN=C(O2)C3=C(C(=C(C=C3)OC)[N+](=O)[O-])Cl

Isomeric SMILES

CC(C)OC(=O)C1=CC=CC=C1C2=NN=C(O2)C3=C(C(=C(C=C3)OC)[N+](=O)[O-])Cl

InChI

InChI=1S/C19H16ClN3O6/c1-10(2)28-19(24)12-7-5-4-6-11(12)17-21-22-18(29-17)13-8-9-14(27-3)16(15(13)20)23(25)26/h4-10H,1-3H3