3-aminocarbonyl-3-azanyl-5-methyl-4,6-bis(oxidanyl)hexanoic acid; 2-azanylbutanedioic acid

Systemtic Name: 3-aminocarbonyl-3-azanyl-5-methyl-4,6-bis(oxidanyl)hexanoic acid; 2-azanylbutanedioic acid Openeye Name: 2-aminobutanedioic acid; 3-amino-3-carbamoyl-4,6-dihydroxy-5-methyl-hexanoic acid CAS Name: 2-aminobutanedioic acid; 3-amino-3-carbamoyl-4,6-dihydroxy-5-methylhexanoic acid IUPAC Name: 2-aminobutanedioic acid; 3-amino-3-carbamoyl-4,6-dihydroxy-5-methylhexanoic acid Traditional Name: 3-amino-3-carbamoyl-4,6-dihydroxy-5-methyl-hexanoic acid; 2-aminosuccinic acid Formula: C12H23N3O9 MolecularWeight: 353.32572

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Descriptors Computed from Structure

Canonical SMILES:

CC(CO)C(C(CC(=O)O)(C(=O)N)N)O.C(C(C(=O)O)N)C(=O)O

Isomeric SMILES

CC(CO)C(C(CC(=O)O)(C(=O)N)N)O.C(C(C(=O)O)N)C(=O)O

InChI

InChI=1S/C8H16N2O5.C4H7NO4/c1-4(3-11)6(14)8(10,7(9)15)2-5(12)13;5-2(4(8)9)1-3(6)7/h4,6,11,14H,2-3,10H2,1H3,(H2,9,15)(H,12,13);2H,1,5H2,(H,6,7)(H,8,9)