ethyl 4-[4-[3-(4-methylphenyl)-1,2,4-oxadiazol-5-yl]piperidin-1-yl]sulfonylbenzoate

Systemtic Name: ethyl 4-[4-[3-(4-methylphenyl)-1,2,4-oxadiazol-5-yl]piperidin-1-yl]sulfonylbenzoate Openeye Name: ethyl 4-[[4-[3-(p-tolyl)-1,2,4-oxadiazol-5-yl]-1-piperidyl]sulfonyl]benzoate CAS Name: 4-[[4-[3-(4-methylphenyl)-1,2,4-oxadiazol-5-yl]-1-piperidinyl]sulfonyl]benzoic acid ethyl ester IUPAC Name: ethyl 4-[4-[3-(4-methylphenyl)-1,2,4-oxadiazol-5-yl]piperidin-1-yl]sulfonylbenzoate Traditional Name: 4-[4-[3-(p-tolyl)-1,2,4-oxadiazol-5-yl]piperidino]sulfonylbenzoic acid ethyl ester Formula: C23H25N3O5S MolecularWeight: 455.5267

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC=C(C=C1)S(=O)(=O)N2CCC(CC2)C3=NC(=NO3)C4=CC=C(C=C4)C

Isomeric SMILES

CCOC(=O)C1=CC=C(C=C1)S(=O)(=O)N2CCC(CC2)C3=NC(=NO3)C4=CC=C(C=C4)C

InChI

InChI=1S/C23H25N3O5S/c1-3-30-23(27)19-8-10-20(11-9-19)32(28,29)26-14-12-18(13-15-26)22-24-21(25-31-22)17-6-4-16(2)5-7-17/h4-11,18H,3,12-15H2,1-2H3