3-(1H-imidazol-5-yl)-2-(16-methylheptadecanoylamino)propanoic acid

Systemtic Name: 3-(1H-imidazol-5-yl)-2-(16-methylheptadecanoylamino)propanoic acid Openeye Name: 3-(1H-imidazol-5-yl)-2-(16-methylheptadecanoylamino)propanoic acid CAS Name: 3-(1H-imidazol-5-yl)-2-[(16-methyl-1-oxoheptadecyl)amino]propanoic acid IUPAC Name: 3-(1H-imidazol-5-yl)-2-(16-methylheptadecanoylamino)propanoic acid Traditional Name: 3-(1H-imidazol-5-yl)-2-(16-methylheptadecanoylamino)propionic acid Formula: C24H43N3O3 MolecularWeight: 421.61652

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)CCCCCCCCCCCCCCC(=O)NC(CC1=CN=CN1)C(=O)O

Isomeric SMILES

CC(C)CCCCCCCCCCCCCCC(=O)NC(CC1=CN=CN1)C(=O)O

InChI

InChI=1S/C24H43N3O3/c1-20(2)15-13-11-9-7-5-3-4-6-8-10-12-14-16-23(28)27-22(24(29)30)17-21-18-25-19-26-21/h18-20,22H,3-17H2,1-2H3,(H,25,26)(H,27,28)(H,29,30)