2-bromanyl-N-(oxolan-2-ylmethyl)-5-pyrrolidin-1-ylsulfonyl-benzamide

Systemtic Name: 2-bromanyl-N-(oxolan-2-ylmethyl)-5-pyrrolidin-1-ylsulfonyl-benzamide Openeye Name: 2-bromo-5-pyrrolidin-1-ylsulfonyl-N-(tetrahydrofuran-2-ylmethyl)benzamide CAS Name: 2-bromo-N-(2-oxolanylmethyl)-5-(1-pyrrolidinylsulfonyl)benzamide IUPAC Name: 2-bromo-N-(oxolan-2-ylmethyl)-5-pyrrolidin-1-ylsulfonylbenzamide Traditional Name: 2-bromo-5-pyrrolidinosulfonyl-N-(tetrahydrofurfuryl)benzamide Formula: C16H21BrN2O4S MolecularWeight: 417.31794

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)S(=O)(=O)C2=CC(=C(C=C2)Br)C(=O)NCC3CCCO3

Isomeric SMILES

C1CCN(C1)S(=O)(=O)C2=CC(=C(C=C2)Br)C(=O)NCC3CCCO3

InChI

InChI=1S/C16H21BrN2O4S/c17-15-6-5-13(24(21,22)19-7-1-2-8-19)10-14(15)16(20)18-11-12-4-3-9-23-12/h5-6,10,12H,1-4,7-9,11H2,(H,18,20)