(5-thiophen-2-yl-1,2-oxazol-3-yl)methyl 4-piperidin-1-ylsulfonylbenzoate

Systemtic Name: (5-thiophen-2-yl-1,2-oxazol-3-yl)methyl 4-piperidin-1-ylsulfonylbenzoate Openeye Name: [5-(2-thienyl)isoxazol-3-yl]methyl 4-(1-piperidylsulfonyl)benzoate CAS Name: 4-(1-piperidinylsulfonyl)benzoic acid (5-thiophen-2-yl-3-isoxazolyl)methyl ester IUPAC Name: (5-thiophen-2-yl-1,2-oxazol-3-yl)methyl 4-piperidin-1-ylsulfonylbenzoate Traditional Name: 4-piperidinosulfonylbenzoic acid [5-(2-thienyl)isoxazol-3-yl]methyl ester Formula: C20H20N2O5S2 MolecularWeight: 432.5132

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)S(=O)(=O)C2=CC=C(C=C2)C(=O)OCC3=NOC(=C3)C4=CC=CS4

Isomeric SMILES

C1CCN(CC1)S(=O)(=O)C2=CC=C(C=C2)C(=O)OCC3=NOC(=C3)C4=CC=CS4

InChI

InChI=1S/C20H20N2O5S2/c23-20(26-14-16-13-18(27-21-16)19-5-4-12-28-19)15-6-8-17(9-7-15)29(24,25)22-10-2-1-3-11-22/h4-9,12-13H,1-3,10-11,14H2