[3-(4-chlorophenyl)-1,2,4-oxadiazol-5-yl]methyl 4-pyrrolidin-1-ylsulfonylbenzoate

Systemtic Name: [3-(4-chlorophenyl)-1,2,4-oxadiazol-5-yl]methyl 4-pyrrolidin-1-ylsulfonylbenzoate Openeye Name: [3-(4-chlorophenyl)-1,2,4-oxadiazol-5-yl]methyl 4-pyrrolidin-1-ylsulfonylbenzoate CAS Name: 4-(1-pyrrolidinylsulfonyl)benzoic acid [3-(4-chlorophenyl)-1,2,4-oxadiazol-5-yl]methyl ester IUPAC Name: [3-(4-chlorophenyl)-1,2,4-oxadiazol-5-yl]methyl 4-pyrrolidin-1-ylsulfonylbenzoate Traditional Name: 4-pyrrolidinosulfonylbenzoic acid [3-(4-chlorophenyl)-1,2,4-oxadiazol-5-yl]methyl ester Formula: C20H18ClN3O5S MolecularWeight: 447.89202

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)S(=O)(=O)C2=CC=C(C=C2)C(=O)OCC3=NC(=NO3)C4=CC=C(C=C4)Cl

Isomeric SMILES

C1CCN(C1)S(=O)(=O)C2=CC=C(C=C2)C(=O)OCC3=NC(=NO3)C4=CC=C(C=C4)Cl

InChI

InChI=1S/C20H18ClN3O5S/c21-16-7-3-14(4-8-16)19-22-18(29-23-19)13-28-20(25)15-5-9-17(10-6-15)30(26,27)24-11-1-2-12-24/h3-10H,1-2,11-13H2