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

Systemtic Name: [(1S)-1-[5-(4-methoxyphenyl)-1,3,4-oxadiazol-2-yl]ethyl] 2-azanyl-5-nitro-benzoate Openeye Name: [(1S)-1-[5-(4-methoxyphenyl)-1,3,4-oxadiazol-2-yl]ethyl] 2-amino-5-nitro-benzoate CAS Name: 2-amino-5-nitrobenzoic acid [(1S)-1-[5-(4-methoxyphenyl)-1,3,4-oxadiazol-2-yl]ethyl] ester IUPAC Name: [(1S)-1-[5-(4-methoxyphenyl)-1,3,4-oxadiazol-2-yl]ethyl] 2-amino-5-nitrobenzoate Traditional Name: 2-amino-5-nitro-benzoic acid [(1S)-1-[5-(4-methoxyphenyl)-1,3,4-oxadiazol-2-yl]ethyl] ester Formula: C18H16N4O6 MolecularWeight: 384.34284

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C1=NN=C(O1)C2=CC=C(C=C2)OC)OC(=O)C3=C(C=CC(=C3)[N+](=O)[O-])N

Isomeric SMILES

C[C@@H](C1=NN=C(O1)C2=CC=C(C=C2)OC)OC(=O)C3=C(C=CC(=C3)[N+](=O)[O-])N

InChI

InChI=1S/C18H16N4O6/c1-10(27-18(23)14-9-12(22(24)25)5-8-15(14)19)16-20-21-17(28-16)11-3-6-13(26-2)7-4-11/h3-10H,19H2,1-2H3/t10-/m0/s1