2-azanyl-4-oxidanylidene-4-(2-pyridin-4-ylethylcarbamoyloxy)butanoic acid; 2-azanylpropanoic acid; 3-methyl-2-(methylamino)butanoic acid

Systemtic Name: 2-azanyl-4-oxidanylidene-4-(2-pyridin-4-ylethylcarbamoyloxy)butanoic acid; 2-azanylpropanoic acid; 3-methyl-2-(methylamino)butanoic acid Openeye Name: 2-amino-4-oxo-4-[2-(4-pyridyl)ethylcarbamoyloxy]butanoic acid; 2-aminopropanoic acid; 3-methyl-2-(methylamino)butanoic acid CAS Name: 2-amino-4-oxo-4-[oxo-(2-pyridin-4-ylethylamino)methoxy]butanoic acid; 2-aminopropanoic acid; 3-methyl-2-(methylamino)butanoic acid IUPAC Name: 2-amino-4-oxo-4-(2-pyridin-4-ylethylcarbamoyloxy)butanoic acid; 2-aminopropanoic acid; 3-methyl-2-(methylamino)butanoic acid Traditional Name: 2-amino-4-keto-4-[2-(4-pyridyl)ethylcarbamoyloxy]butyric acid; 2-aminopropionic acid; 3-methyl-2-(methylamino)butyric acid Formula: C21H35N5O9 MolecularWeight: 501.5307

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(C(=O)O)NC.CC(C(=O)O)N.C1=CN=CC=C1CCNC(=O)OC(=O)CC(C(=O)O)N

Isomeric SMILES

CC(C)C(C(=O)O)NC.CC(C(=O)O)N.C1=CN=CC=C1CCNC(=O)OC(=O)CC(C(=O)O)N

InChI

InChI=1S/C12H15N3O5.C6H13NO2.C3H7NO2/c13-9(11(17)18)7-10(16)20-12(19)15-6-3-8-1-4-14-5-2-8;1-4(2)5(7-3)6(8)9;1-2(4)3(5)6/h1-2,4-5,9H,3,6-7,13H2,(H,15,19)(H,17,18);4-5,7H,1-3H3,(H,8,9);2H,4H2,1H3,(H,5,6)