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

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

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)S(=O)(=O)N2CCCCC2)C(=O)OCC3=NC(=NO3)C

Isomeric SMILES

CC1=C(C=C(C=C1)S(=O)(=O)N2CCCCC2)C(=O)OCC3=NC(=NO3)C

InChI

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