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

Systemtic Name: methyl 2-[4-[5-(4-methylphenyl)-1,3,4-oxadiazol-2-yl]piperidin-1-yl]sulfonylbenzoate Openeye Name: methyl 2-[[4-[5-(p-tolyl)-1,3,4-oxadiazol-2-yl]-1-piperidyl]sulfonyl]benzoate CAS Name: 2-[[4-[5-(4-methylphenyl)-1,3,4-oxadiazol-2-yl]-1-piperidinyl]sulfonyl]benzoic acid methyl ester IUPAC Name: methyl 2-[4-[5-(4-methylphenyl)-1,3,4-oxadiazol-2-yl]piperidin-1-yl]sulfonylbenzoate Traditional Name: 2-[4-[5-(p-tolyl)-1,3,4-oxadiazol-2-yl]piperidino]sulfonylbenzoic acid methyl ester Formula: C22H23N3O5S MolecularWeight: 441.50012

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C2=NN=C(O2)C3CCN(CC3)S(=O)(=O)C4=CC=CC=C4C(=O)OC

Isomeric SMILES

CC1=CC=C(C=C1)C2=NN=C(O2)C3CCN(CC3)S(=O)(=O)C4=CC=CC=C4C(=O)OC

InChI

InChI=1S/C22H23N3O5S/c1-15-7-9-16(10-8-15)20-23-24-21(30-20)17-11-13-25(14-12-17)31(27,28)19-6-4-3-5-18(19)22(26)29-2/h3-10,17H,11-14H2,1-2H3