[1-[bis(fluoranyl)methyl]imidazol-2-yl]methyl 3-pyrrolidin-1-ylsulfonylbenzoate

Systemtic Name: [1-[bis(fluoranyl)methyl]imidazol-2-yl]methyl 3-pyrrolidin-1-ylsulfonylbenzoate Openeye Name: [1-(difluoromethyl)imidazol-2-yl]methyl 3-pyrrolidin-1-ylsulfonylbenzoate CAS Name: 3-(1-pyrrolidinylsulfonyl)benzoic acid [1-(difluoromethyl)-2-imidazolyl]methyl ester IUPAC Name: [1-(difluoromethyl)imidazol-2-yl]methyl 3-pyrrolidin-1-ylsulfonylbenzoate Traditional Name: 3-pyrrolidinosulfonylbenzoic acid [1-(difluoromethyl)imidazol-2-yl]methyl ester Formula: C16H17F2N3O4S MolecularWeight: 385.385686

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)S(=O)(=O)C2=CC=CC(=C2)C(=O)OCC3=NC=CN3C(F)F

Isomeric SMILES

C1CCN(C1)S(=O)(=O)C2=CC=CC(=C2)C(=O)OCC3=NC=CN3C(F)F

InChI

InChI=1S/C16H17F2N3O4S/c17-16(18)21-9-6-19-14(21)11-25-15(22)12-4-3-5-13(10-12)26(23,24)20-7-1-2-8-20/h3-6,9-10,16H,1-2,7-8,11H2