1-[(6-bromanyl-1,3-benzodioxol-5-yl)oxy]-3-(octylamino)propan-2-ol

Systemtic Name: 1-[(6-bromanyl-1,3-benzodioxol-5-yl)oxy]-3-(octylamino)propan-2-ol Openeye Name: 1-[(6-bromo-1,3-benzodioxol-5-yl)oxy]-3-(octylamino)propan-2-ol CAS Name: 1-[(6-bromo-1,3-benzodioxol-5-yl)oxy]-3-(octylamino)-2-propanol IUPAC Name: 1-[(6-bromo-1,3-benzodioxol-5-yl)oxy]-3-(octylamino)propan-2-ol Traditional Name: 1-[(6-bromo-1,3-benzodioxol-5-yl)oxy]-3-(octylamino)propan-2-ol Formula: C18H28BrNO4 MolecularWeight: 402.32322

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCNCC(COC1=C(C=C2C(=C1)OCO2)Br)O

Isomeric SMILES

CCCCCCCCNCC(COC1=C(C=C2C(=C1)OCO2)Br)O

InChI

InChI=1S/C18H28BrNO4/c1-2-3-4-5-6-7-8-20-11-14(21)12-22-16-10-18-17(9-15(16)19)23-13-24-18/h9-10,14,20-21H,2-8,11-13H2,1H3