3-[3-(4-azanylbutyl)phenoxy]propane-1,2-diol

Systemtic Name: 3-[3-(4-azanylbutyl)phenoxy]propane-1,2-diol Openeye Name: 3-[3-(4-aminobutyl)phenoxy]propane-1,2-diol CAS Name: 3-[3-(4-aminobutyl)phenoxy]propane-1,2-diol IUPAC Name: 3-[3-(4-aminobutyl)phenoxy]propane-1,2-diol Traditional Name: 3-[3-(4-aminobutyl)phenoxy]propane-1,2-diol Formula: C13H21NO3 MolecularWeight: 239.31074

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)OCC(CO)O)CCCCN

Isomeric SMILES

C1=CC(=CC(=C1)OCC(CO)O)CCCCN

InChI

InChI=1S/C13H21NO3/c14-7-2-1-4-11-5-3-6-13(8-11)17-10-12(16)9-15/h3,5-6,8,12,15-16H,1-2,4,7,9-10,14H2