methyl 4-[5-[(4-pyridin-4-ylpiperazin-1-yl)methyl]-1,2,4-oxadiazol-3-yl]benzoate

Systemtic Name: methyl 4-[5-[(4-pyridin-4-ylpiperazin-1-yl)methyl]-1,2,4-oxadiazol-3-yl]benzoate Openeye Name: methyl 4-[5-[[4-(4-pyridyl)piperazin-1-yl]methyl]-1,2,4-oxadiazol-3-yl]benzoate CAS Name: 4-[5-[(4-pyridin-4-yl-1-piperazinyl)methyl]-1,2,4-oxadiazol-3-yl]benzoic acid methyl ester IUPAC Name: methyl 4-[5-[(4-pyridin-4-ylpiperazin-1-yl)methyl]-1,2,4-oxadiazol-3-yl]benzoate Traditional Name: 4-[5-[[4-(4-pyridyl)piperazino]methyl]-1,2,4-oxadiazol-3-yl]benzoic acid methyl ester Formula: C20H21N5O3 MolecularWeight: 379.41244

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC=C(C=C1)C2=NOC(=N2)CN3CCN(CC3)C4=CC=NC=C4

Isomeric SMILES

COC(=O)C1=CC=C(C=C1)C2=NOC(=N2)CN3CCN(CC3)C4=CC=NC=C4

InChI

InChI=1S/C20H21N5O3/c1-27-20(26)16-4-2-15(3-5-16)19-22-18(28-23-19)14-24-10-12-25(13-11-24)17-6-8-21-9-7-17/h2-9H,10-14H2,1H3