N-[2-(1,3-benzodioxol-5-yloxy)ethyl]-4-fluoranyl-3-methyl-benzenesulfonamide

Systemtic Name: N-[2-(1,3-benzodioxol-5-yloxy)ethyl]-4-fluoranyl-3-methyl-benzenesulfonamide Openeye Name: N-[2-(1,3-benzodioxol-5-yloxy)ethyl]-4-fluoro-3-methyl-benzenesulfonamide CAS Name: N-[2-(1,3-benzodioxol-5-yloxy)ethyl]-4-fluoro-3-methylbenzenesulfonamide IUPAC Name: N-[2-(1,3-benzodioxol-5-yloxy)ethyl]-4-fluoro-3-methylbenzenesulfonamide Traditional Name: N-[2-(1,3-benzodioxol-5-yloxy)ethyl]-4-fluoro-3-methyl-benzenesulfonamide Formula: C16H16FNO5S MolecularWeight: 353.365343

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)S(=O)(=O)NCCOC2=CC3=C(C=C2)OCO3)F

Isomeric SMILES

CC1=C(C=CC(=C1)S(=O)(=O)NCCOC2=CC3=C(C=C2)OCO3)F

InChI

InChI=1S/C16H16FNO5S/c1-11-8-13(3-4-14(11)17)24(19,20)18-6-7-21-12-2-5-15-16(9-12)23-10-22-15/h2-5,8-9,18H,6-7,10H2,1H3