[(1R)-1-(5-phenyl-1,3,4-oxadiazol-2-yl)ethyl] 2-(2-hydroxyethylamino)-5-nitro-benzoate

Systemtic Name: [(1R)-1-(5-phenyl-1,3,4-oxadiazol-2-yl)ethyl] 2-(2-hydroxyethylamino)-5-nitro-benzoate Openeye Name: [(1R)-1-(5-phenyl-1,3,4-oxadiazol-2-yl)ethyl] 2-(2-hydroxyethylamino)-5-nitro-benzoate CAS Name: 2-(2-hydroxyethylamino)-5-nitrobenzoic acid [(1R)-1-(5-phenyl-1,3,4-oxadiazol-2-yl)ethyl] ester IUPAC Name: [(1R)-1-(5-phenyl-1,3,4-oxadiazol-2-yl)ethyl] 2-(2-hydroxyethylamino)-5-nitrobenzoate Traditional Name: 2-(2-hydroxyethylamino)-5-nitro-benzoic acid [(1R)-1-(5-phenyl-1,3,4-oxadiazol-2-yl)ethyl] ester Formula: C19H18N4O6 MolecularWeight: 398.36942

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C19H18N4O6/c1-12(17-21-22-18(29-17)13-5-3-2-4-6-13)28-19(25)15-11-14(23(26)27)7-8-16(15)20-9-10-24/h2-8,11-12,20,24H,9-10H2,1H3/t12-/m1/s1