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

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

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC=C1[N+](=O)[O-])C(=O)OC(C)C2=NN=C(O2)C3=CC=C(C=C3)OC

Isomeric SMILES

CC1=C(C=CC=C1[N+](=O)[O-])C(=O)OC(C)C2=NN=C(O2)C3=CC=C(C=C3)OC

InChI

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