3-[4-[2-(aminocarbonylamino)-3-methyl-butanoyl]piperazin-1-yl]propanoic acid

Systemtic Name: 3-[4-[2-(aminocarbonylamino)-3-methyl-butanoyl]piperazin-1-yl]propanoic acid Openeye Name: 3-[4-(3-methyl-2-ureido-butanoyl)piperazin-1-yl]propanoic acid CAS Name: 3-[4-[2-(carbamoylamino)-3-methyl-1-oxobutyl]-1-piperazinyl]propanoic acid IUPAC Name: 3-[4-[2-(carbamoylamino)-3-methylbutanoyl]piperazin-1-yl]propanoic acid Traditional Name: 3-[4-(3-methyl-2-ureido-butanoyl)piperazino]propionic acid Formula: C13H24N4O4 MolecularWeight: 300.35406

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(C(=O)N1CCN(CC1)CCC(=O)O)NC(=O)N

Isomeric SMILES

CC(C)C(C(=O)N1CCN(CC1)CCC(=O)O)NC(=O)N

InChI

InChI=1S/C13H24N4O4/c1-9(2)11(15-13(14)21)12(20)17-7-5-16(6-8-17)4-3-10(18)19/h9,11H,3-8H2,1-2H3,(H,18,19)(H3,14,15,21)