4-[[(6-bromanyl-2,3-dihydro-1,4-benzodioxin-7-yl)methyl-cyclopropyl-amino]methyl]-N-methyl-benzamide

Systemtic Name: 4-[[(6-bromanyl-2,3-dihydro-1,4-benzodioxin-7-yl)methyl-cyclopropyl-amino]methyl]-N-methyl-benzamide Openeye Name: 4-[[(6-bromo-2,3-dihydro-1,4-benzodioxin-7-yl)methyl-cyclopropyl-amino]methyl]-N-methyl-benzamide CAS Name: 4-[[(6-bromo-2,3-dihydro-1,4-benzodioxin-7-yl)methyl-cyclopropylamino]methyl]-N-methylbenzamide IUPAC Name: 4-[[(6-bromo-2,3-dihydro-1,4-benzodioxin-7-yl)methyl-cyclopropylamino]methyl]-N-methylbenzamide Traditional Name: 4-[[(6-bromo-2,3-dihydro-1,4-benzodioxin-7-yl)methyl-cyclopropyl-amino]methyl]-N-methyl-benzamide Formula: C21H23BrN2O3 MolecularWeight: 431.32292

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Descriptors Computed from Structure

Canonical SMILES:

CNC(=O)C1=CC=C(C=C1)CN(CC2=CC3=C(C=C2Br)OCCO3)C4CC4

Isomeric SMILES

CNC(=O)C1=CC=C(C=C1)CN(CC2=CC3=C(C=C2Br)OCCO3)C4CC4

InChI

InChI=1S/C21H23BrN2O3/c1-23-21(25)15-4-2-14(3-5-15)12-24(17-6-7-17)13-16-10-19-20(11-18(16)22)27-9-8-26-19/h2-5,10-11,17H,6-9,12-13H2,1H3,(H,23,25)