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3-(1H-imidazol-5-yl)-2-[3-(nonanoylamino)propanoylamino]propanoic acid

3-(1H-imidazol-5-yl)-2-[3-(nonanoylamino)propanoylamino]propanoic acid

Systemtic Name:3-(1H-imidazol-5-yl)-2-[3-(nonanoylamino)propanoylamino]propanoic acid
Openeye Name:3-(1H-imidazol-5-yl)-2-[3-(nonanoylamino)propanoylamino]propanoic acid
CAS Name:3-(1H-imidazol-5-yl)-2-[[1-oxo-3-(1-oxononylamino)propyl]amino]propanoic acid
IUPAC Name:3-(1H-imidazol-5-yl)-2-[3-(nonanoylamino)propanoylamino]propanoic acid
Traditional Name:3-(1H-imidazol-5-yl)-2-[3-(pelargonylamino)propanoylamino]propionic acid
Formula: C18H30N4O4
MolecularWeight: 366.4552
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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCC(=O)NCCC(=O)NC(CC1=CN=CN1)C(=O)O


Isomeric SMILES

CCCCCCCCC(=O)NCCC(=O)NC(CC1=CN=CN1)C(=O)O


InChI

InChI=1S/C18H30N4O4/c1-2-3-4-5-6-7-8-16(23)20-10-9-17(24)22-15(18(25)26)11-14-12-19-13-21-14/h12-13,15H,2-11H2,1H3,(H,19,21)(H,20,23)(H,22,24)(H,25,26)


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