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

Systemtic Name: methyl 2-[(5-bromanyl-2,3-dihydro-1,4-benzodioxin-7-yl)methylamino]ethanoate Openeye Name: methyl 2-[(5-bromo-2,3-dihydro-1,4-benzodioxin-7-yl)methylamino]acetate CAS Name: 2-[(5-bromo-2,3-dihydro-1,4-benzodioxin-7-yl)methylamino]acetic acid methyl ester IUPAC Name: methyl 2-[(5-bromo-2,3-dihydro-1,4-benzodioxin-7-yl)methylamino]acetate Traditional Name: 2-[(5-bromo-2,3-dihydro-1,4-benzodioxin-7-yl)methylamino]acetic acid methyl ester Formula: C12H14BrNO4 MolecularWeight: 316.14786

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC(=O)CNCC1=CC2=C(C(=C1)Br)OCCO2

Isomeric SMILES

COC(=O)CNCC1=CC2=C(C(=C1)Br)OCCO2

InChI

InChI=1S/C12H14BrNO4/c1-16-11(15)7-14-6-8-4-9(13)12-10(5-8)17-2-3-18-12/h4-5,14H,2-3,6-7H2,1H3