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

Systemtic Name: 6-(1-azanyl-1-oxidanylidene-hexadecan-3-yl)oxy-6-oxidanylidene-5-(pyridin-2-ylmethylamino)hexanoic acid Openeye Name: 6-[1-(2-amino-2-oxo-ethyl)tetradecoxy]-6-oxo-5-(2-pyridylmethylamino)hexanoic acid CAS Name: 6-(1-amino-1-oxohexadecan-3-yl)oxy-6-oxo-5-(2-pyridinylmethylamino)hexanoic acid IUPAC Name: 6-(1-amino-1-oxohexadecan-3-yl)oxy-6-oxo-5-(pyridin-2-ylmethylamino)hexanoic acid Traditional Name: 6-[1-(2-amino-2-keto-ethyl)tetradecoxy]-6-keto-5-(2-pyridylmethylamino)hexanoic acid Formula: C28H47N3O5 MolecularWeight: 505.68988

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCC(CC(=O)N)OC(=O)C(CCCC(=O)O)NCC1=CC=CC=N1

Isomeric SMILES

CCCCCCCCCCCCCC(CC(=O)N)OC(=O)C(CCCC(=O)O)NCC1=CC=CC=N1

InChI

InChI=1S/C28H47N3O5/c1-2-3-4-5-6-7-8-9-10-11-12-17-24(21-26(29)32)36-28(35)25(18-15-19-27(33)34)31-22-23-16-13-14-20-30-23/h13-14,16,20,24-25,31H,2-12,15,17-19,21-22H2,1H3,(H2,29,32)(H,33,34)