2-(1-oxidanylcyclohexyl)butanoic acid; 2-(trimethylazaniumyl)ethanoate

Systemtic Name: 2-(1-oxidanylcyclohexyl)butanoic acid; 2-(trimethylazaniumyl)ethanoate Openeye Name: 2-(1-hydroxycyclohexyl)butanoic acid; 2-(trimethylammonio)acetate CAS Name: 2-(1-hydroxycyclohexyl)butanoic acid; 2-(trimethylammonio)acetate IUPAC Name: 2-(1-hydroxycyclohexyl)butanoic acid; 2-(trimethylazaniumyl)acetate Traditional Name: 2-(1-hydroxycyclohexyl)butyric acid; 2-(trimethylammonio)acetate Formula: C15H29NO5 MolecularWeight: 303.39446

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC(C(=O)O)C1(CCCCC1)O.C[N+](C)(C)CC(=O)[O-]

Isomeric SMILES

CCC(C(=O)O)C1(CCCCC1)O.C[N+](C)(C)CC(=O)[O-]

InChI

InChI=1S/C10H18O3.C5H11NO2/c1-2-8(9(11)12)10(13)6-4-3-5-7-10;1-6(2,3)4-5(7)8/h8,13H,2-7H2,1H3,(H,11,12);4H2,1-3H3