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ethyl (E,4S)-4-(2-oxidanylidenehexadecanoylamino)oct-2-enoate

ethyl (E,4S)-4-(2-oxidanylidenehexadecanoylamino)oct-2-enoate

Systemtic Name:ethyl (E,4S)-4-(2-oxidanylidenehexadecanoylamino)oct-2-enoate
Openeye Name:ethyl (E,4S)-4-(2-oxohexadecanoylamino)oct-2-enoate
CAS Name:(E,4S)-4-(1,2-dioxohexadecylamino)-2-octenoic acid ethyl ester
IUPAC Name:ethyl (E,4S)-4-(2-oxohexadecanoylamino)oct-2-enoate
Traditional Name:(E,4S)-4-(2-ketohexadecanoylamino)oct-2-enoic acid ethyl ester
Formula: C26H47NO4
MolecularWeight: 437.65568
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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCC(=O)C(=O)NC(CCCC)C=CC(=O)OCC


Isomeric SMILES

CCCCCCCCCCCCCCC(=O)C(=O)N[C@@H](CCCC)/C=C/C(=O)OCC


InChI

InChI=1S/C26H47NO4/c1-4-7-9-10-11-12-13-14-15-16-17-18-20-24(28)26(30)27-23(19-8-5-2)21-22-25(29)31-6-3/h21-23H,4-20H2,1-3H3,(H,27,30)/b22-21+/t23-/m0/s1


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