[5-(1-benzofuran-2-yl)-1,2-oxazol-3-yl]methyl 1-thiophen-2-ylcyclopentane-1-carboxylate

Systemtic Name: [5-(1-benzofuran-2-yl)-1,2-oxazol-3-yl]methyl 1-thiophen-2-ylcyclopentane-1-carboxylate Openeye Name: [5-(benzofuran-2-yl)isoxazol-3-yl]methyl 1-(2-thienyl)cyclopentanecarboxylate CAS Name: 1-thiophen-2-yl-1-cyclopentanecarboxylic acid [5-(2-benzofuranyl)-3-isoxazolyl]methyl ester IUPAC Name: [5-(1-benzofuran-2-yl)-1,2-oxazol-3-yl]methyl 1-thiophen-2-ylcyclopentane-1-carboxylate Traditional Name: 1-(2-thienyl)cyclopentanecarboxylic acid [5-(benzofuran-2-yl)isoxazol-3-yl]methyl ester Formula: C22H19NO4S MolecularWeight: 393.45556

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(C1)(C2=CC=CS2)C(=O)OCC3=NOC(=C3)C4=CC5=CC=CC=C5O4

Isomeric SMILES

C1CCC(C1)(C2=CC=CS2)C(=O)OCC3=NOC(=C3)C4=CC5=CC=CC=C5O4

InChI

InChI=1S/C22H19NO4S/c24-21(22(9-3-4-10-22)20-8-5-11-28-20)25-14-16-13-19(27-23-16)18-12-15-6-1-2-7-17(15)26-18/h1-2,5-8,11-13H,3-4,9-10,14H2