N-[(5-fluoranyl-7-methylsulfonyl-2,3-dihydro-1,4-benzodioxin-2-yl)methyl]-2-methyl-propan-1-amine

Systemtic Name: N-[(5-fluoranyl-7-methylsulfonyl-2,3-dihydro-1,4-benzodioxin-2-yl)methyl]-2-methyl-propan-1-amine Openeye Name: N-[(5-fluoro-7-methylsulfonyl-2,3-dihydro-1,4-benzodioxin-2-yl)methyl]-2-methyl-propan-1-amine CAS Name: N-[(5-fluoro-7-methylsulfonyl-2,3-dihydro-1,4-benzodioxin-2-yl)methyl]-2-methyl-1-propanamine IUPAC Name: N-[(5-fluoro-7-methylsulfonyl-2,3-dihydro-1,4-benzodioxin-2-yl)methyl]-2-methylpropan-1-amine Traditional Name: (5-fluoro-7-mesyl-2,3-dihydro-1,4-benzodioxin-2-yl)methyl-isobutyl-amine Formula: C14H20FNO4S MolecularWeight: 317.376303

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CNCC1COC2=C(C=C(C=C2O1)S(=O)(=O)C)F

Isomeric SMILES

CC(C)CNCC1COC2=C(C=C(C=C2O1)S(=O)(=O)C)F

InChI

InChI=1S/C14H20FNO4S/c1-9(2)6-16-7-10-8-19-14-12(15)4-11(21(3,17)18)5-13(14)20-10/h4-5,9-10,16H,6-8H2,1-3H3