3-[2-(2-azanylpropanoylamino)propanoylamino]-4-(carboxymethylamino)-4-oxidanylidene-butanoic acid

Systemtic Name: 3-[2-(2-azanylpropanoylamino)propanoylamino]-4-(carboxymethylamino)-4-oxidanylidene-butanoic acid Openeye Name: 3-[2-(2-aminopropanoylamino)propanoylamino]-4-(carboxymethylamino)-4-oxo-butanoic acid CAS Name: 3-[[2-[(2-amino-1-oxopropyl)amino]-1-oxopropyl]amino]-4-(carboxymethylamino)-4-oxobutanoic acid IUPAC Name: 3-[2-(2-aminopropanoylamino)propanoylamino]-4-(carboxymethylamino)-4-oxobutanoic acid Traditional Name: 3-[2-(alanylamino)propanoylamino]-4-(carboxymethylamino)-4-keto-butyric acid Formula: C12H20N4O7 MolecularWeight: 332.3098

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C12H20N4O7/c1-5(13)10(21)15-6(2)11(22)16-7(3-8(17)18)12(23)14-4-9(19)20/h5-7H,3-4,13H2,1-2H3,(H,14,23)(H,15,21)(H,16,22)(H,17,18)(H,19,20)