2-[2-[2-(2-azanylpropanoylamino)propanoylamino]ethanoylamino]-3-methyl-butanoic acid

Systemtic Name: 2-[2-[2-(2-azanylpropanoylamino)propanoylamino]ethanoylamino]-3-methyl-butanoic acid Openeye Name: 2-[[2-[2-(2-aminopropanoylamino)propanoylamino]acetyl]amino]-3-methyl-butanoic acid CAS Name: 2-[[2-[[2-[(2-amino-1-oxopropyl)amino]-1-oxopropyl]amino]-1-oxoethyl]amino]-3-methylbutanoic acid IUPAC Name: 2-[[2-[2-(2-aminopropanoylamino)propanoylamino]acetyl]amino]-3-methylbutanoic acid Traditional Name: 2-[[2-[2-(alanylamino)propanoylamino]acetyl]amino]-3-methyl-butyric acid Formula: C13H24N4O5 MolecularWeight: 316.35346

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(C(=O)O)NC(=O)CNC(=O)C(C)NC(=O)C(C)N

Isomeric SMILES

CC(C)C(C(=O)O)NC(=O)CNC(=O)C(C)NC(=O)C(C)N

InChI

InChI=1S/C13H24N4O5/c1-6(2)10(13(21)22)17-9(18)5-15-12(20)8(4)16-11(19)7(3)14/h6-8,10H,5,14H2,1-4H3,(H,15,20)(H,16,19)(H,17,18)(H,21,22)