[5-(4-nitrophenyl)-1,3,4-oxadiazol-2-yl]methyl 3-bromanyl-5-ethoxy-4-methoxy-benzoate

Systemtic Name: [5-(4-nitrophenyl)-1,3,4-oxadiazol-2-yl]methyl 3-bromanyl-5-ethoxy-4-methoxy-benzoate Openeye Name: [5-(4-nitrophenyl)-1,3,4-oxadiazol-2-yl]methyl 3-bromo-5-ethoxy-4-methoxy-benzoate CAS Name: 3-bromo-5-ethoxy-4-methoxybenzoic acid [5-(4-nitrophenyl)-1,3,4-oxadiazol-2-yl]methyl ester IUPAC Name: [5-(4-nitrophenyl)-1,3,4-oxadiazol-2-yl]methyl 3-bromo-5-ethoxy-4-methoxybenzoate Traditional Name: 3-bromo-5-ethoxy-4-methoxy-benzoic acid [5-(4-nitrophenyl)-1,3,4-oxadiazol-2-yl]methyl ester Formula: C19H16BrN3O7 MolecularWeight: 478.25024

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C(=CC(=C1)C(=O)OCC2=NN=C(O2)C3=CC=C(C=C3)[N+](=O)[O-])Br)OC

Isomeric SMILES

CCOC1=C(C(=CC(=C1)C(=O)OCC2=NN=C(O2)C3=CC=C(C=C3)[N+](=O)[O-])Br)OC

InChI

InChI=1S/C19H16BrN3O7/c1-3-28-15-9-12(8-14(20)17(15)27-2)19(24)29-10-16-21-22-18(30-16)11-4-6-13(7-5-11)23(25)26/h4-9H,3,10H2,1-2H3