2-(2-hydroxyethyloxy)ethyl 2-azanyl-6-(6-octylpyridin-3-yl)-3,4-bis(oxidanyl)hexanoate

Systemtic Name: 2-(2-hydroxyethyloxy)ethyl 2-azanyl-6-(6-octylpyridin-3-yl)-3,4-bis(oxidanyl)hexanoate Openeye Name: 2-(2-hydroxyethoxy)ethyl 2-amino-3,4-dihydroxy-6-(6-octyl-3-pyridyl)hexanoate CAS Name: 2-amino-3,4-dihydroxy-6-(6-octyl-3-pyridinyl)hexanoic acid 2-(2-hydroxyethoxy)ethyl ester IUPAC Name: 2-(2-hydroxyethoxy)ethyl 2-amino-3,4-dihydroxy-6-(6-octylpyridin-3-yl)hexanoate Traditional Name: 2-amino-3,4-dihydroxy-6-(6-octyl-3-pyridyl)hexanoic acid 2-(2-hydroxyethoxy)ethyl ester Formula: C23H40N2O6 MolecularWeight: 440.5735

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C23H40N2O6/c1-2-3-4-5-6-7-8-19-11-9-18(17-25-19)10-12-20(27)22(28)21(24)23(29)31-16-15-30-14-13-26/h9,11,17,20-22,26-28H,2-8,10,12-16,24H2,1H3