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4-[6-(3-fluoranyl-4-methoxy-phenyl)-1,3-benzodioxol-5-yl]benzenesulfonamide

4-[6-(3-fluoranyl-4-methoxy-phenyl)-1,3-benzodioxol-5-yl]benzenesulfonamide

Systemtic Name:4-[6-(3-fluoranyl-4-methoxy-phenyl)-1,3-benzodioxol-5-yl]benzenesulfonamide
Openeye Name:4-[6-(3-fluoro-4-methoxy-phenyl)-1,3-benzodioxol-5-yl]benzenesulfonamide
CAS Name:4-[6-(3-fluoro-4-methoxyphenyl)-1,3-benzodioxol-5-yl]benzenesulfonamide
IUPAC Name:4-[6-(3-fluoro-4-methoxyphenyl)-1,3-benzodioxol-5-yl]benzenesulfonamide
Traditional Name:4-[6-(3-fluoro-4-methoxy-phenyl)-1,3-benzodioxol-5-yl]benzenesulfonamide
Formula: C20H16FNO5S
MolecularWeight: 401.408143
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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C2=CC3=C(C=C2C4=CC=C(C=C4)S(=O)(=O)N)OCO3)F


Isomeric SMILES

COC1=C(C=C(C=C1)C2=CC3=C(C=C2C4=CC=C(C=C4)S(=O)(=O)N)OCO3)F


InChI

InChI=1S/C20H16FNO5S/c1-25-18-7-4-13(8-17(18)21)16-10-20-19(26-11-27-20)9-15(16)12-2-5-14(6-3-12)28(22,23)24/h2-10H,11H2,1H3,(H2,22,23,24)


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