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

Systemtic Name: 6-(1-azanyl-1-oxidanylidene-hexadecan-3-yl)oxy-6-oxidanylidene-5-(pyridin-2-ylcarbonylamino)hexanoic acid Openeye Name: 6-[1-(2-amino-2-oxo-ethyl)tetradecoxy]-6-oxo-5-(pyridine-2-carbonylamino)hexanoic acid CAS Name: 6-(1-amino-1-oxohexadecan-3-yl)oxy-6-oxo-5-[[oxo(2-pyridinyl)methyl]amino]hexanoic acid IUPAC Name: 6-(1-amino-1-oxohexadecan-3-yl)oxy-6-oxo-5-(pyridine-2-carbonylamino)hexanoic acid Traditional Name: 6-[1-(2-amino-2-keto-ethyl)tetradecoxy]-6-keto-5-picolinamido-hexanoic acid Formula: C28H45N3O6 MolecularWeight: 519.6734

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCC(CC(=O)N)OC(=O)C(CCCC(=O)O)NC(=O)C1=CC=CC=N1

Isomeric SMILES

CCCCCCCCCCCCCC(CC(=O)N)OC(=O)C(CCCC(=O)O)NC(=O)C1=CC=CC=N1

InChI

InChI=1S/C28H45N3O6/c1-2-3-4-5-6-7-8-9-10-11-12-16-22(21-25(29)32)37-28(36)24(18-15-19-26(33)34)31-27(35)23-17-13-14-20-30-23/h13-14,17,20,22,24H,2-12,15-16,18-19,21H2,1H3,(H2,29,32)(H,31,35)(H,33,34)