(5-phenyl-1,2-oxazol-3-yl)methyl 3-pyrrolidin-1-ylsulfonylbenzoate

Systemtic Name: (5-phenyl-1,2-oxazol-3-yl)methyl 3-pyrrolidin-1-ylsulfonylbenzoate Openeye Name: (5-phenylisoxazol-3-yl)methyl 3-pyrrolidin-1-ylsulfonylbenzoate CAS Name: 3-(1-pyrrolidinylsulfonyl)benzoic acid (5-phenyl-3-isoxazolyl)methyl ester IUPAC Name: (5-phenyl-1,2-oxazol-3-yl)methyl 3-pyrrolidin-1-ylsulfonylbenzoate Traditional Name: 3-pyrrolidinosulfonylbenzoic acid (5-phenylisoxazol-3-yl)methyl ester Formula: C21H20N2O5S MolecularWeight: 412.4589

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)S(=O)(=O)C2=CC=CC(=C2)C(=O)OCC3=NOC(=C3)C4=CC=CC=C4

Isomeric SMILES

C1CCN(C1)S(=O)(=O)C2=CC=CC(=C2)C(=O)OCC3=NOC(=C3)C4=CC=CC=C4

InChI

InChI=1S/C21H20N2O5S/c24-21(27-15-18-14-20(28-22-18)16-7-2-1-3-8-16)17-9-6-10-19(13-17)29(25,26)23-11-4-5-12-23/h1-3,6-10,13-14H,4-5,11-12,15H2