[(1R)-1-[5-(4-nitrophenyl)-1,3,4-oxadiazol-2-yl]ethyl] adamantane-2-carboxylate

Systemtic Name: [(1R)-1-[5-(4-nitrophenyl)-1,3,4-oxadiazol-2-yl]ethyl] adamantane-2-carboxylate Openeye Name: [(1R)-1-[5-(4-nitrophenyl)-1,3,4-oxadiazol-2-yl]ethyl] adamantane-2-carboxylate CAS Name: 2-adamantanecarboxylic acid [(1R)-1-[5-(4-nitrophenyl)-1,3,4-oxadiazol-2-yl]ethyl] ester IUPAC Name: [(1R)-1-[5-(4-nitrophenyl)-1,3,4-oxadiazol-2-yl]ethyl] adamantane-2-carboxylate Traditional Name: adamantane-2-carboxylic acid [(1R)-1-[5-(4-nitrophenyl)-1,3,4-oxadiazol-2-yl]ethyl] ester Formula: C21H23N3O5 MolecularWeight: 397.42442

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=NN=C(O1)C2=CC=C(C=C2)[N+](=O)[O-])OC(=O)C3C4CC5CC(C4)CC3C5

Isomeric SMILES

C[C@H](C1=NN=C(O1)C2=CC=C(C=C2)[N+](=O)[O-])OC(=O)C3C4CC5CC(C4)CC3C5

InChI

InChI=1S/C21H23N3O5/c1-11(19-22-23-20(29-19)14-2-4-17(5-3-14)24(26)27)28-21(25)18-15-7-12-6-13(9-15)10-16(18)8-12/h2-5,11-13,15-16,18H,6-10H2,1H3/t11-,12?,13?,15?,16?,18?/m1/s1