3-[[3-(2-azanylphenoxy)-2-oxidanyl-propyl]-methyl-amino]propanenitrile

Systemtic Name: 3-[[3-(2-azanylphenoxy)-2-oxidanyl-propyl]-methyl-amino]propanenitrile Openeye Name: 3-[[3-(2-aminophenoxy)-2-hydroxy-propyl]-methyl-amino]propanenitrile CAS Name: 3-[[3-(2-aminophenoxy)-2-hydroxypropyl]-methylamino]propanenitrile IUPAC Name: 3-[[3-(2-aminophenoxy)-2-hydroxypropyl]-methylamino]propanenitrile Traditional Name: 3-[[3-(2-aminophenoxy)-2-hydroxy-propyl]-methyl-amino]propionitrile Formula: C13H19N3O2 MolecularWeight: 249.30886

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CN(CCC#N)CC(COC1=CC=CC=C1N)O

Isomeric SMILES

CN(CCC#N)CC(COC1=CC=CC=C1N)O

InChI

InChI=1S/C13H19N3O2/c1-16(8-4-7-14)9-11(17)10-18-13-6-3-2-5-12(13)15/h2-3,5-6,11,17H,4,8-10,15H2,1H3