[5-(4-nitrophenyl)-1,3,4-oxadiazol-2-yl]methyl 2-(1-adamantyl)ethanoate

Systemtic Name: [5-(4-nitrophenyl)-1,3,4-oxadiazol-2-yl]methyl 2-(1-adamantyl)ethanoate Openeye Name: [5-(4-nitrophenyl)-1,3,4-oxadiazol-2-yl]methyl 2-(1-adamantyl)acetate CAS Name: 2-(1-adamantyl)acetic acid [5-(4-nitrophenyl)-1,3,4-oxadiazol-2-yl]methyl ester IUPAC Name: [5-(4-nitrophenyl)-1,3,4-oxadiazol-2-yl]methyl 2-(1-adamantyl)acetate Traditional Name: 2-(1-adamantyl)acetic acid [5-(4-nitrophenyl)-1,3,4-oxadiazol-2-yl]methyl ester Formula: C21H23N3O5 MolecularWeight: 397.42442

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Descriptors Computed from Structure

Canonical SMILES:

C1C2CC3CC1CC(C2)(C3)CC(=O)OCC4=NN=C(O4)C5=CC=C(C=C5)[N+](=O)[O-]

Isomeric SMILES

C1C2CC3CC1CC(C2)(C3)CC(=O)OCC4=NN=C(O4)C5=CC=C(C=C5)[N+](=O)[O-]

InChI

InChI=1S/C21H23N3O5/c25-19(11-21-8-13-5-14(9-21)7-15(6-13)10-21)28-12-18-22-23-20(29-18)16-1-3-17(4-2-16)24(26)27/h1-4,13-15H,5-12H2