tert-butyl 2,2,4-trimethyl-3-(2-oxidanylideneheptyl)-1,3-oxazolidin-3-ium-3-carboxylate

Systemtic Name: tert-butyl 2,2,4-trimethyl-3-(2-oxidanylideneheptyl)-1,3-oxazolidin-3-ium-3-carboxylate Openeye Name: tert-butyl 2,2,4-trimethyl-3-(2-oxoheptyl)oxazolidin-3-ium-3-carboxylate CAS Name: 2,2,4-trimethyl-3-(2-oxoheptyl)-3-oxazolidin-3-iumcarboxylic acid tert-butyl ester IUPAC Name: tert-butyl 2,2,4-trimethyl-3-(2-oxoheptyl)-1,3-oxazolidin-3-ium-3-carboxylate Traditional Name: 3-(2-ketoheptyl)-2,2,4-trimethyl-oxazolidin-3-ium-3-carboxylic acid tert-butyl ester Formula: C18H34NO4+ MolecularWeight: 328.46686

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC(=O)C[N+]1(C(COC1(C)C)C)C(=O)OC(C)(C)C

Isomeric SMILES

CCCCCC(=O)C[N+]1(C(COC1(C)C)C)C(=O)OC(C)(C)C

InChI

InChI=1S/C18H34NO4/c1-8-9-10-11-15(20)12-19(16(21)23-17(3,4)5)14(2)13-22-18(19,6)7/h14H,8-13H2,1-7H3/q+1