(3-propan-2-yl-1,2,4-oxadiazol-5-yl)methyl 2-piperidin-1-ylsulfonylbenzoate

Systemtic Name: (3-propan-2-yl-1,2,4-oxadiazol-5-yl)methyl 2-piperidin-1-ylsulfonylbenzoate Openeye Name: (3-isopropyl-1,2,4-oxadiazol-5-yl)methyl 2-(1-piperidylsulfonyl)benzoate CAS Name: 2-(1-piperidinylsulfonyl)benzoic acid (3-propan-2-yl-1,2,4-oxadiazol-5-yl)methyl ester IUPAC Name: (3-propan-2-yl-1,2,4-oxadiazol-5-yl)methyl 2-piperidin-1-ylsulfonylbenzoate Traditional Name: 2-piperidinosulfonylbenzoic acid (3-isopropyl-1,2,4-oxadiazol-5-yl)methyl ester Formula: C18H23N3O5S MolecularWeight: 393.45732

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=NOC(=N1)COC(=O)C2=CC=CC=C2S(=O)(=O)N3CCCCC3

Isomeric SMILES

CC(C)C1=NOC(=N1)COC(=O)C2=CC=CC=C2S(=O)(=O)N3CCCCC3

InChI

InChI=1S/C18H23N3O5S/c1-13(2)17-19-16(26-20-17)12-25-18(22)14-8-4-5-9-15(14)27(23,24)21-10-6-3-7-11-21/h4-5,8-9,13H,3,6-7,10-12H2,1-2H3