(5-methyl-1,3,4-oxadiazol-2-yl)methyl 4-methyl-3-piperidin-1-ylsulfonyl-benzoate

Systemtic Name: (5-methyl-1,3,4-oxadiazol-2-yl)methyl 4-methyl-3-piperidin-1-ylsulfonyl-benzoate Openeye Name: (5-methyl-1,3,4-oxadiazol-2-yl)methyl 4-methyl-3-(1-piperidylsulfonyl)benzoate CAS Name: 4-methyl-3-(1-piperidinylsulfonyl)benzoic acid (5-methyl-1,3,4-oxadiazol-2-yl)methyl ester IUPAC Name: (5-methyl-1,3,4-oxadiazol-2-yl)methyl 4-methyl-3-piperidin-1-ylsulfonylbenzoate Traditional Name: 4-methyl-3-piperidinosulfonyl-benzoic acid (5-methyl-1,3,4-oxadiazol-2-yl)methyl ester Formula: C17H21N3O5S MolecularWeight: 379.43074

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C(=O)OCC2=NN=C(O2)C)S(=O)(=O)N3CCCCC3

Isomeric SMILES

CC1=C(C=C(C=C1)C(=O)OCC2=NN=C(O2)C)S(=O)(=O)N3CCCCC3

InChI

InChI=1S/C17H21N3O5S/c1-12-6-7-14(17(21)24-11-16-19-18-13(2)25-16)10-15(12)26(22,23)20-8-4-3-5-9-20/h6-7,10H,3-5,8-9,11H2,1-2H3