tert-butyl 4-(3-fluoranyl-4-methoxy-phenyl)sulfonylpiperazine-1-carboxylate

Systemtic Name: tert-butyl 4-(3-fluoranyl-4-methoxy-phenyl)sulfonylpiperazine-1-carboxylate Openeye Name: tert-butyl 4-(3-fluoro-4-methoxy-phenyl)sulfonylpiperazine-1-carboxylate CAS Name: 4-(3-fluoro-4-methoxyphenyl)sulfonyl-1-piperazinecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl 4-(3-fluoro-4-methoxyphenyl)sulfonylpiperazine-1-carboxylate Traditional Name: 4-(3-fluoro-4-methoxy-phenyl)sulfonylpiperazine-1-carboxylic acid tert-butyl ester Formula: C16H23FN2O5S MolecularWeight: 374.427623

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)N1CCN(CC1)S(=O)(=O)C2=CC(=C(C=C2)OC)F

Isomeric SMILES

CC(C)(C)OC(=O)N1CCN(CC1)S(=O)(=O)C2=CC(=C(C=C2)OC)F

InChI

InChI=1S/C16H23FN2O5S/c1-16(2,3)24-15(20)18-7-9-19(10-8-18)25(21,22)12-5-6-14(23-4)13(17)11-12/h5-6,11H,7-10H2,1-4H3