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

Systemtic Name: tert-butyl 1-[4-[5-(acetamidomethyl)-2-oxidanylidene-1,3-oxazolidin-3-yl]-2-fluoranyl-phenyl]piperazin-1-ium-1-carboxylate Openeye Name: tert-butyl 1-[4-[5-(acetamidomethyl)-2-oxo-oxazolidin-3-yl]-2-fluoro-phenyl]piperazin-1-ium-1-carboxylate CAS Name: 1-[4-[5-(acetamidomethyl)-2-oxo-3-oxazolidinyl]-2-fluorophenyl]-1-piperazin-1-iumcarboxylic acid tert-butyl ester IUPAC Name: tert-butyl 1-[4-[5-(acetamidomethyl)-2-oxo-1,3-oxazolidin-3-yl]-2-fluorophenyl]piperazin-1-ium-1-carboxylate Traditional Name: 1-[4-[5-(acetamidomethyl)-2-keto-oxazolidin-3-yl]-2-fluoro-phenyl]piperazin-1-ium-1-carboxylic acid tert-butyl ester Formula: C21H30FN4O5+ MolecularWeight: 437.485103

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NCC1CN(C(=O)O1)C2=CC(=C(C=C2)[N+]3(CCNCC3)C(=O)OC(C)(C)C)F

Isomeric SMILES

CC(=O)NCC1CN(C(=O)O1)C2=CC(=C(C=C2)[N+]3(CCNCC3)C(=O)OC(C)(C)C)F

InChI

InChI=1S/C21H29FN4O5/c1-14(27)24-12-16-13-25(19(28)30-16)15-5-6-18(17(22)11-15)26(9-7-23-8-10-26)20(29)31-21(2,3)4/h5-6,11,16,23H,7-10,12-13H2,1-4H3/p+1