[5-(3-methylphenyl)-1,3,4-oxadiazol-2-yl]methyl 4-ethoxy-3-nitro-benzoate

Systemtic Name: [5-(3-methylphenyl)-1,3,4-oxadiazol-2-yl]methyl 4-ethoxy-3-nitro-benzoate Openeye Name: [5-(m-tolyl)-1,3,4-oxadiazol-2-yl]methyl 4-ethoxy-3-nitro-benzoate CAS Name: 4-ethoxy-3-nitrobenzoic acid [5-(3-methylphenyl)-1,3,4-oxadiazol-2-yl]methyl ester IUPAC Name: [5-(3-methylphenyl)-1,3,4-oxadiazol-2-yl]methyl 4-ethoxy-3-nitrobenzoate Traditional Name: 4-ethoxy-3-nitro-benzoic acid [5-(m-tolyl)-1,3,4-oxadiazol-2-yl]methyl ester Formula: C19H17N3O6 MolecularWeight: 383.35478

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C19H17N3O6/c1-3-26-16-8-7-14(10-15(16)22(24)25)19(23)27-11-17-20-21-18(28-17)13-6-4-5-12(2)9-13/h4-10H,3,11H2,1-2H3