6-(1-azanyl-1-oxidanylidene-hexadecan-3-yl)oxy-6-oxidanylidene-5-(2-pyridin-2-ylethanoylamino)hexanoic acid

Systemtic Name: 6-(1-azanyl-1-oxidanylidene-hexadecan-3-yl)oxy-6-oxidanylidene-5-(2-pyridin-2-ylethanoylamino)hexanoic acid Openeye Name: 6-[1-(2-amino-2-oxo-ethyl)tetradecoxy]-6-oxo-5-[[2-(2-pyridyl)acetyl]amino]hexanoic acid CAS Name: 6-(1-amino-1-oxohexadecan-3-yl)oxy-6-oxo-5-[[1-oxo-2-(2-pyridinyl)ethyl]amino]hexanoic acid IUPAC Name: 6-(1-amino-1-oxohexadecan-3-yl)oxy-6-oxo-5-[(2-pyridin-2-ylacetyl)amino]hexanoic acid Traditional Name: 6-[1-(2-amino-2-keto-ethyl)tetradecoxy]-6-keto-5-[[2-(2-pyridyl)acetyl]amino]hexanoic acid Formula: C29H47N3O6 MolecularWeight: 533.69998

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCC(CC(=O)N)OC(=O)C(CCCC(=O)O)NC(=O)CC1=CC=CC=N1

Isomeric SMILES

CCCCCCCCCCCCCC(CC(=O)N)OC(=O)C(CCCC(=O)O)NC(=O)CC1=CC=CC=N1

InChI

InChI=1S/C29H47N3O6/c1-2-3-4-5-6-7-8-9-10-11-12-17-24(22-26(30)33)38-29(37)25(18-15-19-28(35)36)32-27(34)21-23-16-13-14-20-31-23/h13-14,16,20,24-25H,2-12,15,17-19,21-22H2,1H3,(H2,30,33)(H,32,34)(H,35,36)