N-[(3R)-1-(1,3-benzodioxol-5-ylmethyl)pyrrolidin-3-yl]-5-fluoranyl-2-methyl-benzenesulfonamide

Systemtic Name: N-[(3R)-1-(1,3-benzodioxol-5-ylmethyl)pyrrolidin-3-yl]-5-fluoranyl-2-methyl-benzenesulfonamide Openeye Name: N-[(3R)-1-(1,3-benzodioxol-5-ylmethyl)pyrrolidin-3-yl]-5-fluoro-2-methyl-benzenesulfonamide CAS Name: N-[(3R)-1-(1,3-benzodioxol-5-ylmethyl)-3-pyrrolidinyl]-5-fluoro-2-methylbenzenesulfonamide IUPAC Name: N-[(3R)-1-(1,3-benzodioxol-5-ylmethyl)pyrrolidin-3-yl]-5-fluoro-2-methylbenzenesulfonamide Traditional Name: 5-fluoro-2-methyl-N-[(3R)-1-piperonylpyrrolidin-3-yl]benzenesulfonamide Formula: C19H21FN2O4S MolecularWeight: 392.444443

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)F)S(=O)(=O)NC2CCN(C2)CC3=CC4=C(C=C3)OCO4

Isomeric SMILES

CC1=C(C=C(C=C1)F)S(=O)(=O)N[C@@H]2CCN(C2)CC3=CC4=C(C=C3)OCO4

InChI

InChI=1S/C19H21FN2O4S/c1-13-2-4-15(20)9-19(13)27(23,24)21-16-6-7-22(11-16)10-14-3-5-17-18(8-14)26-12-25-17/h2-5,8-9,16,21H,6-7,10-12H2,1H3/t16-/m1/s1