[(1S)-1-(5-thiophen-2-yl-1,3,4-oxadiazol-2-yl)ethyl] 2-methyl-6-nitro-benzoate

Systemtic Name: [(1S)-1-(5-thiophen-2-yl-1,3,4-oxadiazol-2-yl)ethyl] 2-methyl-6-nitro-benzoate Openeye Name: [(1S)-1-[5-(2-thienyl)-1,3,4-oxadiazol-2-yl]ethyl] 2-methyl-6-nitro-benzoate CAS Name: 2-methyl-6-nitrobenzoic acid [(1S)-1-(5-thiophen-2-yl-1,3,4-oxadiazol-2-yl)ethyl] ester IUPAC Name: [(1S)-1-(5-thiophen-2-yl-1,3,4-oxadiazol-2-yl)ethyl] 2-methyl-6-nitrobenzoate Traditional Name: 2-methyl-6-nitro-benzoic acid [(1S)-1-[5-(2-thienyl)-1,3,4-oxadiazol-2-yl]ethyl] ester Formula: C16H13N3O5S MolecularWeight: 359.35652

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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=CS3

Isomeric SMILES

CC1=C(C(=CC=C1)[N+](=O)[O-])C(=O)O[C@@H](C)C2=NN=C(O2)C3=CC=CS3

InChI

InChI=1S/C16H13N3O5S/c1-9-5-3-6-11(19(21)22)13(9)16(20)23-10(2)14-17-18-15(24-14)12-7-4-8-25-12/h3-8,10H,1-2H3/t10-/m0/s1