2-[[3-methyl-2-(2-oxidanylbutanoylamino)butanoyl]amino]butanedioic acid

Systemtic Name: 2-[[3-methyl-2-(2-oxidanylbutanoylamino)butanoyl]amino]butanedioic acid Openeye Name: 2-[[2-(2-hydroxybutanoylamino)-3-methyl-butanoyl]amino]butanedioic acid CAS Name: 2-[[2-[(2-hydroxy-1-oxobutyl)amino]-3-methyl-1-oxobutyl]amino]butanedioic acid IUPAC Name: 2-[[2-(2-hydroxybutanoylamino)-3-methylbutanoyl]amino]butanedioic acid Traditional Name: 2-[[2-(2-hydroxybutanoylamino)-3-methyl-butanoyl]amino]succinic acid Formula: C13H22N2O7 MolecularWeight: 318.32298

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C(=O)NC(C(C)C)C(=O)NC(CC(=O)O)C(=O)O)O

Isomeric SMILES

CCC(C(=O)NC(C(C)C)C(=O)NC(CC(=O)O)C(=O)O)O

InChI

InChI=1S/C13H22N2O7/c1-4-8(16)11(19)15-10(6(2)3)12(20)14-7(13(21)22)5-9(17)18/h6-8,10,16H,4-5H2,1-3H3,(H,14,20)(H,15,19)(H,17,18)(H,21,22)