N-[(6-bromanyl-2,3-dihydro-1,4-benzodioxin-7-yl)methyl]-N-methyl-1-(4-methylsulfonylphenyl)ethanamine

Systemtic Name: N-[(6-bromanyl-2,3-dihydro-1,4-benzodioxin-7-yl)methyl]-N-methyl-1-(4-methylsulfonylphenyl)ethanamine Openeye Name: N-[(6-bromo-2,3-dihydro-1,4-benzodioxin-7-yl)methyl]-N-methyl-1-(4-methylsulfonylphenyl)ethanamine CAS Name: N-[(6-bromo-2,3-dihydro-1,4-benzodioxin-7-yl)methyl]-N-methyl-1-(4-methylsulfonylphenyl)ethanamine IUPAC Name: N-[(6-bromo-2,3-dihydro-1,4-benzodioxin-7-yl)methyl]-N-methyl-1-(4-methylsulfonylphenyl)ethanamine Traditional Name: (6-bromo-2,3-dihydro-1,4-benzodioxin-7-yl)methyl-[1-(4-mesylphenyl)ethyl]-methyl-amine Formula: C19H22BrNO4S MolecularWeight: 440.35128

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC=C(C=C1)S(=O)(=O)C)N(C)CC2=CC3=C(C=C2Br)OCCO3

Isomeric SMILES

CC(C1=CC=C(C=C1)S(=O)(=O)C)N(C)CC2=CC3=C(C=C2Br)OCCO3

InChI

InChI=1S/C19H22BrNO4S/c1-13(14-4-6-16(7-5-14)26(3,22)23)21(2)12-15-10-18-19(11-17(15)20)25-9-8-24-18/h4-7,10-11,13H,8-9,12H2,1-3H3