2-[(5-bromanyl-2,3-dihydro-1,4-benzodioxin-7-yl)methylamino]butan-1-ol

Systemtic Name: 2-[(5-bromanyl-2,3-dihydro-1,4-benzodioxin-7-yl)methylamino]butan-1-ol Openeye Name: 2-[(5-bromo-2,3-dihydro-1,4-benzodioxin-7-yl)methylamino]butan-1-ol CAS Name: 2-[(5-bromo-2,3-dihydro-1,4-benzodioxin-7-yl)methylamino]-1-butanol IUPAC Name: 2-[(5-bromo-2,3-dihydro-1,4-benzodioxin-7-yl)methylamino]butan-1-ol Traditional Name: 2-[(5-bromo-2,3-dihydro-1,4-benzodioxin-7-yl)methylamino]butan-1-ol Formula: C13H18BrNO3 MolecularWeight: 316.19092

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Descriptors Computed from Structure

Canonical SMILES:

CCC(CO)NCC1=CC2=C(C(=C1)Br)OCCO2

Isomeric SMILES

CCC(CO)NCC1=CC2=C(C(=C1)Br)OCCO2

InChI

InChI=1S/C13H18BrNO3/c1-2-10(8-16)15-7-9-5-11(14)13-12(6-9)17-3-4-18-13/h5-6,10,15-16H,2-4,7-8H2,1H3