1-(4-bromanyl-3-fluoranyl-butyl)-5-[(2S)-2-(methoxymethyl)pyrrolidin-1-yl]sulfonyl-indole-2,3-dione

Systemtic Name: 1-(4-bromanyl-3-fluoranyl-butyl)-5-[(2S)-2-(methoxymethyl)pyrrolidin-1-yl]sulfonyl-indole-2,3-dione Openeye Name: 1-(4-bromo-3-fluoro-butyl)-5-[(2S)-2-(methoxymethyl)pyrrolidin-1-yl]sulfonyl-indoline-2,3-dione CAS Name: 1-(4-bromo-3-fluorobutyl)-5-[[(2S)-2-(methoxymethyl)-1-pyrrolidinyl]sulfonyl]indole-2,3-dione IUPAC Name: 1-(4-bromo-3-fluorobutyl)-5-[(2S)-2-(methoxymethyl)pyrrolidin-1-yl]sulfonylindole-2,3-dione Traditional Name: 1-(4-bromo-3-fluoro-butyl)-5-[(2S)-2-(methoxymethyl)pyrrolidino]sulfonyl-isatin Formula: C18H22BrFN2O5S MolecularWeight: 477.345083

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Descriptors Computed from Structure

Canonical SMILES:

COCC1CCCN1S(=O)(=O)C2=CC3=C(C=C2)N(C(=O)C3=O)CCC(CBr)F

Isomeric SMILES

COC[C@@H]1CCCN1S(=O)(=O)C2=CC3=C(C=C2)N(C(=O)C3=O)CCC(CBr)F

InChI

InChI=1S/C18H22BrFN2O5S/c1-27-11-13-3-2-7-22(13)28(25,26)14-4-5-16-15(9-14)17(23)18(24)21(16)8-6-12(20)10-19/h4-5,9,12-13H,2-3,6-8,10-11H2,1H3/t12?,13-/m0/s1