4-azanyl-2-[2-[2-(2-azanylpropanoylamino)propanoylamino]ethanoylamino]-4-oxidanylidene-butanoic acid

Systemtic Name: 4-azanyl-2-[2-[2-(2-azanylpropanoylamino)propanoylamino]ethanoylamino]-4-oxidanylidene-butanoic acid Openeye Name: 4-amino-2-[[2-[2-(2-aminopropanoylamino)propanoylamino]acetyl]amino]-4-oxo-butanoic acid CAS Name: 4-amino-2-[[2-[[2-[(2-amino-1-oxopropyl)amino]-1-oxopropyl]amino]-1-oxoethyl]amino]-4-oxobutanoic acid IUPAC Name: 4-amino-2-[[2-[2-(2-aminopropanoylamino)propanoylamino]acetyl]amino]-4-oxobutanoic acid Traditional Name: 2-[[2-[2-(alanylamino)propanoylamino]acetyl]amino]-4-amino-4-keto-butyric acid Formula: C12H21N5O6 MolecularWeight: 331.32504

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C12H21N5O6/c1-5(13)10(20)16-6(2)11(21)15-4-9(19)17-7(12(22)23)3-8(14)18/h5-7H,3-4,13H2,1-2H3,(H2,14,18)(H,15,21)(H,16,20)(H,17,19)(H,22,23)