tert-butyl 1-[2-fluoranyl-4-[5-(hydroxymethyl)-2-oxidanylidene-1,3-oxazolidin-3-yl]phenyl]piperazin-1-ium-1-carboxylate

Systemtic Name: tert-butyl 1-[2-fluoranyl-4-[5-(hydroxymethyl)-2-oxidanylidene-1,3-oxazolidin-3-yl]phenyl]piperazin-1-ium-1-carboxylate Openeye Name: tert-butyl 1-[2-fluoro-4-[5-(hydroxymethyl)-2-oxo-oxazolidin-3-yl]phenyl]piperazin-1-ium-1-carboxylate CAS Name: 1-[2-fluoro-4-[5-(hydroxymethyl)-2-oxo-3-oxazolidinyl]phenyl]-1-piperazin-1-iumcarboxylic acid tert-butyl ester IUPAC Name: tert-butyl 1-[2-fluoro-4-[5-(hydroxymethyl)-2-oxo-1,3-oxazolidin-3-yl]phenyl]piperazin-1-ium-1-carboxylate Traditional Name: 1-[2-fluoro-4-(2-keto-5-methylol-oxazolidin-3-yl)phenyl]piperazin-1-ium-1-carboxylic acid tert-butyl ester Formula: C19H27FN3O5+ MolecularWeight: 396.433183

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)[N+]1(CCNCC1)C2=C(C=C(C=C2)N3CC(OC3=O)CO)F

Isomeric SMILES

CC(C)(C)OC(=O)[N+]1(CCNCC1)C2=C(C=C(C=C2)N3CC(OC3=O)CO)F

InChI

InChI=1S/C19H27FN3O5/c1-19(2,3)28-18(26)23(8-6-21-7-9-23)16-5-4-13(10-15(16)20)22-11-14(12-24)27-17(22)25/h4-5,10,14,21,24H,6-9,11-12H2,1-3H3/q+1