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heptadecyl (2S)-2-(octanoylamino)propanoate

heptadecyl (2S)-2-(octanoylamino)propanoate

Systemtic Name:heptadecyl (2S)-2-(octanoylamino)propanoate
Openeye Name:heptadecyl (2S)-2-(octanoylamino)propanoate
CAS Name:(2S)-2-(1-oxooctylamino)propanoic acid heptadecyl ester
IUPAC Name:heptadecyl (2S)-2-(octanoylamino)propanoate
Traditional Name:(2S)-2-(caprylylamino)propionic acid heptadecyl ester
Formula: C28H55NO3
MolecularWeight: 453.7412
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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCCOC(=O)C(C)NC(=O)CCCCCCC


Isomeric SMILES

CCCCCCCCCCCCCCCCCOC(=O)[C@H](C)NC(=O)CCCCCCC


InChI

InChI=1S/C28H55NO3/c1-4-6-8-10-11-12-13-14-15-16-17-18-19-21-23-25-32-28(31)26(3)29-27(30)24-22-20-9-7-5-2/h26H,4-25H2,1-3H3,(H,29,30)/t26-/m0/s1


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