2-[2-(4-methoxycarbonyl-2,2,4-trimethyl-hexanoyl)oxyethyl-dimethyl-azaniumyl]ethanoate

Systemtic Name: 2-[2-(4-methoxycarbonyl-2,2,4-trimethyl-hexanoyl)oxyethyl-dimethyl-azaniumyl]ethanoate Openeye Name: 2-[2-(4-methoxycarbonyl-2,2,4-trimethyl-hexanoyl)oxyethyl-dimethyl-ammonio]acetate CAS Name: 2-[2-(4-methoxycarbonyl-2,2,4-trimethyl-1-oxohexoxy)ethyl-dimethylammonio]acetate IUPAC Name: 2-[2-(4-methoxycarbonyl-2,2,4-trimethylhexanoyl)oxyethyl-dimethylazaniumyl]acetate Traditional Name: 2-[2-(4-carbomethoxy-2,2,4-trimethyl-hexanoyl)oxyethyl-dimethyl-ammonio]acetate Formula: C17H31NO6 MolecularWeight: 345.43114

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H31NO6/c1-8-17(4,15(22)23-7)12-16(2,3)14(21)24-10-9-18(5,6)11-13(19)20/h8-12H2,1-7H3