ethyl 4-[3-[3-(4-propan-2-ylphenyl)-1,2,4-oxadiazol-5-yl]propanoyl]piperazine-1-carboxylate

Systemtic Name: ethyl 4-[3-[3-(4-propan-2-ylphenyl)-1,2,4-oxadiazol-5-yl]propanoyl]piperazine-1-carboxylate Openeye Name: ethyl 4-[3-[3-(4-isopropylphenyl)-1,2,4-oxadiazol-5-yl]propanoyl]piperazine-1-carboxylate CAS Name: 4-[1-oxo-3-[3-(4-propan-2-ylphenyl)-1,2,4-oxadiazol-5-yl]propyl]-1-piperazinecarboxylic acid ethyl ester IUPAC Name: ethyl 4-[3-[3-(4-propan-2-ylphenyl)-1,2,4-oxadiazol-5-yl]propanoyl]piperazine-1-carboxylate Traditional Name: 4-[3-(3-p-cumenyl-1,2,4-oxadiazol-5-yl)propanoyl]piperazine-1-carboxylic acid ethyl ester Formula: C21H28N4O4 MolecularWeight: 400.47142

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)N1CCN(CC1)C(=O)CCC2=NC(=NO2)C3=CC=C(C=C3)C(C)C

Isomeric SMILES

CCOC(=O)N1CCN(CC1)C(=O)CCC2=NC(=NO2)C3=CC=C(C=C3)C(C)C

InChI

InChI=1S/C21H28N4O4/c1-4-28-21(27)25-13-11-24(12-14-25)19(26)10-9-18-22-20(23-29-18)17-7-5-16(6-8-17)15(2)3/h5-8,15H,4,9-14H2,1-3H3