2-[1-(2-heptyl-4,5-dihydroimidazol-1-yl)ethyl-(1-oxidanyl-1-oxidanylidene-propan-2-yl)amino]propanoic acid

Systemtic Name: 2-[1-(2-heptyl-4,5-dihydroimidazol-1-yl)ethyl-(1-oxidanyl-1-oxidanylidene-propan-2-yl)amino]propanoic acid Openeye Name: 2-[1-(2-heptyl-4,5-dihydroimidazol-1-yl)ethyl-(2-hydroxy-1-methyl-2-oxo-ethyl)amino]propanoic acid CAS Name: 2-[1-(2-heptyl-4,5-dihydroimidazol-1-yl)ethyl-(1-hydroxy-1-oxopropan-2-yl)amino]propanoic acid IUPAC Name: 2-[1-(2-heptyl-4,5-dihydroimidazol-1-yl)ethyl-(1-hydroxy-1-oxopropan-2-yl)amino]propanoic acid Traditional Name: 2-[1-(2-heptyl-2-imidazolin-1-yl)ethyl-(2-hydroxy-2-keto-1-methyl-ethyl)amino]propionic acid Formula: C18H33N3O4 MolecularWeight: 355.47232

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCC1=NCCN1C(C)N(C(C)C(=O)O)C(C)C(=O)O

Isomeric SMILES

CCCCCCCC1=NCCN1C(C)N(C(C)C(=O)O)C(C)C(=O)O

InChI

InChI=1S/C18H33N3O4/c1-5-6-7-8-9-10-16-19-11-12-20(16)15(4)21(13(2)17(22)23)14(3)18(24)25/h13-15H,5-12H2,1-4H3,(H,22,23)(H,24,25)