2-(heptanoylamino)-3-methyl-2-oxidanyl-pentanoic acid

Systemtic Name: 2-(heptanoylamino)-3-methyl-2-oxidanyl-pentanoic acid Openeye Name: 2-(heptanoylamino)-2-hydroxy-3-methyl-pentanoic acid CAS Name: 2-hydroxy-3-methyl-2-(1-oxoheptylamino)pentanoic acid IUPAC Name: 2-(heptanoylamino)-2-hydroxy-3-methylpentanoic acid Traditional Name: 2-(enanthylamino)-2-hydroxy-3-methyl-valeric acid Formula: C13H25NO4 MolecularWeight: 259.3419

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCC(=O)NC(C(C)CC)(C(=O)O)O

Isomeric SMILES

CCCCCCC(=O)NC(C(C)CC)(C(=O)O)O

InChI

InChI=1S/C13H25NO4/c1-4-6-7-8-9-11(15)14-13(18,12(16)17)10(3)5-2/h10,18H,4-9H2,1-3H3,(H,14,15)(H,16,17)