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

Systemtic Name: methyl 4-[[5-(5-methyl-3-phenyl-1,2-oxazol-4-yl)-1,3,4-oxadiazol-2-yl]methoxy]-3-nitro-benzoate Openeye Name: methyl 4-[[5-(5-methyl-3-phenyl-isoxazol-4-yl)-1,3,4-oxadiazol-2-yl]methoxy]-3-nitro-benzoate CAS Name: 4-[[5-(5-methyl-3-phenyl-4-isoxazolyl)-1,3,4-oxadiazol-2-yl]methoxy]-3-nitrobenzoic acid methyl ester IUPAC Name: methyl 4-[[5-(5-methyl-3-phenyl-1,2-oxazol-4-yl)-1,3,4-oxadiazol-2-yl]methoxy]-3-nitrobenzoate Traditional Name: 4-[[5-(5-methyl-3-phenyl-isoxazol-4-yl)-1,3,4-oxadiazol-2-yl]methoxy]-3-nitro-benzoic acid methyl ester Formula: C21H16N4O7 MolecularWeight: 436.37434

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NO1)C2=CC=CC=C2)C3=NN=C(O3)COC4=C(C=C(C=C4)C(=O)OC)[N+](=O)[O-]

Isomeric SMILES

CC1=C(C(=NO1)C2=CC=CC=C2)C3=NN=C(O3)COC4=C(C=C(C=C4)C(=O)OC)[N+](=O)[O-]

InChI

InChI=1S/C21H16N4O7/c1-12-18(19(24-32-12)13-6-4-3-5-7-13)20-23-22-17(31-20)11-30-16-9-8-14(21(26)29-2)10-15(16)25(27)28/h3-10H,11H2,1-2H3