[3-(4-ethylphenyl)-1,2,4-oxadiazol-5-yl]methyl 4-(4-ethanoylpiperazin-1-yl)-4-oxidanylidene-butanoate

Systemtic Name: [3-(4-ethylphenyl)-1,2,4-oxadiazol-5-yl]methyl 4-(4-ethanoylpiperazin-1-yl)-4-oxidanylidene-butanoate Openeye Name: [3-(4-ethylphenyl)-1,2,4-oxadiazol-5-yl]methyl 4-(4-acetylpiperazin-1-yl)-4-oxo-butanoate CAS Name: 4-(4-acetyl-1-piperazinyl)-4-oxobutanoic acid [3-(4-ethylphenyl)-1,2,4-oxadiazol-5-yl]methyl ester IUPAC Name: [3-(4-ethylphenyl)-1,2,4-oxadiazol-5-yl]methyl 4-(4-acetylpiperazin-1-yl)-4-oxobutanoate Traditional Name: 4-(4-acetylpiperazino)-4-keto-butyric acid [3-(4-ethylphenyl)-1,2,4-oxadiazol-5-yl]methyl ester Formula: C21H26N4O5 MolecularWeight: 414.45494

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(C=C1)C2=NOC(=N2)COC(=O)CCC(=O)N3CCN(CC3)C(=O)C

Isomeric SMILES

CCC1=CC=C(C=C1)C2=NOC(=N2)COC(=O)CCC(=O)N3CCN(CC3)C(=O)C

InChI

InChI=1S/C21H26N4O5/c1-3-16-4-6-17(7-5-16)21-22-18(30-23-21)14-29-20(28)9-8-19(27)25-12-10-24(11-13-25)15(2)26/h4-7H,3,8-14H2,1-2H3