hexadecanoic acid; (2R,3S)-3-[(4E,7E)-nona-4,7-dienoyl]oxirane-2-carboxamide

Systemtic Name: hexadecanoic acid; (2R,3S)-3-[(4E,7E)-nona-4,7-dienoyl]oxirane-2-carboxamide Openeye Name: (2R,3S)-3-[(4E,7E)-nona-4,7-dienoyl]oxirane-2-carboxamide; palmitic acid CAS Name: hexadecanoic acid; (2R,3S)-3-[(4E,7E)-1-oxonona-4,7-dienyl]-2-oxiranecarboxamide IUPAC Name: hexadecanoic acid; (2R,3S)-3-[(4E,7E)-nona-4,7-dienoyl]oxirane-2-carboxamide Traditional Name: (2R,3S)-3-[(4E,7E)-nona-4,7-dienoyl]oxirane-2-carboxamide; palmitic acid Formula: C28H49NO5 MolecularWeight: 479.69236

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCC(=O)O.CC=CCC=CCCC(=O)C1C(O1)C(=O)N

Isomeric SMILES

CCCCCCCCCCCCCCCC(=O)O.C/C=C/C/C=C/CCC(=O)[C@@H]1[C@@H](O1)C(=O)N

InChI

InChI=1S/C16H32O2.C12H17NO3/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16(17)18;1-2-3-4-5-6-7-8-9(14)10-11(16-10)12(13)15/h2-15H2,1H3,(H,17,18);2-3,5-6,10-11H,4,7-8H2,1H3,(H2,13,15)/b;3-2+,6-5+/t;10-,11-/m.1/s1