(3R)-3-(2-methylbutanoyloxy)-4-(trimethylazaniumyl)butanoate

Systemtic Name: (3R)-3-(2-methylbutanoyloxy)-4-(trimethylazaniumyl)butanoate Openeye Name: (3R)-3-(2-methylbutanoyloxy)-4-(trimethylammonio)butanoate CAS Name: (3R)-3-(2-methyl-1-oxobutoxy)-4-(trimethylammonio)butanoate IUPAC Name: (3R)-3-(2-methylbutanoyloxy)-4-(trimethylazaniumyl)butanoate Traditional Name: (3R)-3-(2-methylbutanoyloxy)-4-(trimethylammonio)butyrate Formula: C12H23NO4 MolecularWeight: 245.31532

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC(C)C(=O)OC(CC(=O)[O-])C[N+](C)(C)C

Isomeric SMILES

CCC(C)C(=O)O[C@H](CC(=O)[O-])C[N+](C)(C)C

InChI

InChI=1S/C12H23NO4/c1-6-9(2)12(16)17-10(7-11(14)15)8-13(3,4)5/h9-10H,6-8H2,1-5H3/t9?,10-/m1/s1