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

Systemtic Name: 3-(1H-imidazol-5-yl)-2-[3-(tridecanoylamino)propanoylamino]propanoic acid Openeye Name: 3-(1H-imidazol-5-yl)-2-[3-(tridecanoylamino)propanoylamino]propanoic acid CAS Name: 3-(1H-imidazol-5-yl)-2-[[1-oxo-3-(1-oxotridecylamino)propyl]amino]propanoic acid IUPAC Name: 3-(1H-imidazol-5-yl)-2-[3-(tridecanoylamino)propanoylamino]propanoic acid Traditional Name: 3-(1H-imidazol-5-yl)-2-[3-(tridecanoylamino)propanoylamino]propionic acid Formula: C22H38N4O4 MolecularWeight: 422.56152

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C22H38N4O4/c1-2-3-4-5-6-7-8-9-10-11-12-20(27)24-14-13-21(28)26-19(22(29)30)15-18-16-23-17-25-18/h16-17,19H,2-15H2,1H3,(H,23,25)(H,24,27)(H,26,28)(H,29,30)