[4-(1,3,4-oxadiazol-2-yl)phenyl] 3-(3,5-dimethylpiperidin-1-yl)sulfonylbenzoate

Systemtic Name: [4-(1,3,4-oxadiazol-2-yl)phenyl] 3-(3,5-dimethylpiperidin-1-yl)sulfonylbenzoate Openeye Name: [4-(1,3,4-oxadiazol-2-yl)phenyl] 3-[(3,5-dimethyl-1-piperidyl)sulfonyl]benzoate CAS Name: 3-[(3,5-dimethyl-1-piperidinyl)sulfonyl]benzoic acid [4-(1,3,4-oxadiazol-2-yl)phenyl] ester IUPAC Name: [4-(1,3,4-oxadiazol-2-yl)phenyl] 3-(3,5-dimethylpiperidin-1-yl)sulfonylbenzoate Traditional Name: 3-(3,5-dimethylpiperidino)sulfonylbenzoic acid [4-(1,3,4-oxadiazol-2-yl)phenyl] ester Formula: C22H23N3O5S MolecularWeight: 441.50012

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Descriptors Computed from Structure

Canonical SMILES:

CC1CC(CN(C1)S(=O)(=O)C2=CC=CC(=C2)C(=O)OC3=CC=C(C=C3)C4=NN=CO4)C

Isomeric SMILES

CC1CC(CN(C1)S(=O)(=O)C2=CC=CC(=C2)C(=O)OC3=CC=C(C=C3)C4=NN=CO4)C

InChI

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