(2S)-4-methyl-2-[(6-oxidanyl-6-oxidanylidene-hexyl)amino]pentanoic acid

Systemtic Name: (2S)-4-methyl-2-[(6-oxidanyl-6-oxidanylidene-hexyl)amino]pentanoic acid Openeye Name: (2S)-2-[(6-hydroxy-6-oxo-hexyl)amino]-4-methyl-pentanoic acid CAS Name: (2S)-2-[(6-hydroxy-6-oxohexyl)amino]-4-methylpentanoic acid IUPAC Name: (2S)-2-[(6-hydroxy-6-oxohexyl)amino]-4-methylpentanoic acid Traditional Name: (2S)-2-[(6-hydroxy-6-keto-hexyl)amino]-4-methyl-valeric acid Formula: C12H23NO4 MolecularWeight: 245.31532

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC(C(=O)O)NCCCCCC(=O)O

Isomeric SMILES

CC(C)C[C@@H](C(=O)O)NCCCCCC(=O)O

InChI

InChI=1S/C12H23NO4/c1-9(2)8-10(12(16)17)13-7-5-3-4-6-11(14)15/h9-10,13H,3-8H2,1-2H3,(H,14,15)(H,16,17)/t10-/m0/s1