2-azanyl-6-(6-octylpyridin-3-yl)-3,4-bis(oxidanyl)hexanoic acid

Systemtic Name: 2-azanyl-6-(6-octylpyridin-3-yl)-3,4-bis(oxidanyl)hexanoic acid Openeye Name: 2-amino-3,4-dihydroxy-6-(6-octyl-3-pyridyl)hexanoic acid CAS Name: 2-amino-3,4-dihydroxy-6-(6-octyl-3-pyridinyl)hexanoic acid IUPAC Name: 2-amino-3,4-dihydroxy-6-(6-octylpyridin-3-yl)hexanoic acid Traditional Name: 2-amino-3,4-dihydroxy-6-(6-octyl-3-pyridyl)hexanoic acid Formula: C19H32N2O4 MolecularWeight: 352.46838

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCC1=NC=C(C=C1)CCC(C(C(C(=O)O)N)O)O

Isomeric SMILES

CCCCCCCCC1=NC=C(C=C1)CCC(C(C(C(=O)O)N)O)O

InChI

InChI=1S/C19H32N2O4/c1-2-3-4-5-6-7-8-15-11-9-14(13-21-15)10-12-16(22)18(23)17(20)19(24)25/h9,11,13,16-18,22-23H,2-8,10,12,20H2,1H3,(H,24,25)