4-bromanyl-N-[1-[(6-chloranyl-1,3-benzodioxol-5-yl)methyl]pyrrolidin-3-yl]-2-ethyl-benzenesulfonamide

Systemtic Name: 4-bromanyl-N-[1-[(6-chloranyl-1,3-benzodioxol-5-yl)methyl]pyrrolidin-3-yl]-2-ethyl-benzenesulfonamide Openeye Name: 4-bromo-N-[1-[(6-chloro-1,3-benzodioxol-5-yl)methyl]pyrrolidin-3-yl]-2-ethyl-benzenesulfonamide CAS Name: 4-bromo-N-[1-[(6-chloro-1,3-benzodioxol-5-yl)methyl]-3-pyrrolidinyl]-2-ethylbenzenesulfonamide IUPAC Name: 4-bromo-N-[1-[(6-chloro-1,3-benzodioxol-5-yl)methyl]pyrrolidin-3-yl]-2-ethylbenzenesulfonamide Traditional Name: 4-bromo-N-[1-[(6-chloro-1,3-benzodioxol-5-yl)methyl]pyrrolidin-3-yl]-2-ethyl-benzenesulfonamide Formula: C20H22BrClN2O4S MolecularWeight: 501.82168

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(C=CC(=C1)Br)S(=O)(=O)NC2CCN(C2)CC3=CC4=C(C=C3Cl)OCO4

Isomeric SMILES

CCC1=C(C=CC(=C1)Br)S(=O)(=O)NC2CCN(C2)CC3=CC4=C(C=C3Cl)OCO4

InChI

InChI=1S/C20H22BrClN2O4S/c1-2-13-7-15(21)3-4-20(13)29(25,26)23-16-5-6-24(11-16)10-14-8-18-19(9-17(14)22)28-12-27-18/h3-4,7-9,16,23H,2,5-6,10-12H2,1H3