N-[(2R)-2-(2-chloranyl-6-fluoranyl-phenyl)-2-pyrrolidin-1-yl-ethyl]-2,3-dihydro-1,4-benzodioxine-6-sulfonamide

Systemtic Name: N-[(2R)-2-(2-chloranyl-6-fluoranyl-phenyl)-2-pyrrolidin-1-yl-ethyl]-2,3-dihydro-1,4-benzodioxine-6-sulfonamide Openeye Name: N-[(2R)-2-(2-chloro-6-fluoro-phenyl)-2-pyrrolidin-1-yl-ethyl]-2,3-dihydro-1,4-benzodioxine-6-sulfonamide CAS Name: N-[(2R)-2-(2-chloro-6-fluorophenyl)-2-(1-pyrrolidinyl)ethyl]-2,3-dihydro-1,4-benzodioxin-6-sulfonamide IUPAC Name: N-[(2R)-2-(2-chloro-6-fluorophenyl)-2-pyrrolidin-1-ylethyl]-2,3-dihydro-1,4-benzodioxine-6-sulfonamide Traditional Name: N-[(2R)-2-(2-chloro-6-fluoro-phenyl)-2-pyrrolidino-ethyl]-2,3-dihydro-1,4-benzodioxin-6-sulfonamide Formula: C20H22ClFN2O4S MolecularWeight: 440.916083

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)C(CNS(=O)(=O)C2=CC3=C(C=C2)OCCO3)C4=C(C=CC=C4Cl)F

Isomeric SMILES

C1CCN(C1)[C@@H](CNS(=O)(=O)C2=CC3=C(C=C2)OCCO3)C4=C(C=CC=C4Cl)F

InChI

InChI=1S/C20H22ClFN2O4S/c21-15-4-3-5-16(22)20(15)17(24-8-1-2-9-24)13-23-29(25,26)14-6-7-18-19(12-14)28-11-10-27-18/h3-7,12,17,23H,1-2,8-11,13H2/t17-/m0/s1