methyl 1-(3-chloranyl-4-fluoranyl-phenyl)sulfonylpiperidine-2-carboxylate

Systemtic Name: methyl 1-(3-chloranyl-4-fluoranyl-phenyl)sulfonylpiperidine-2-carboxylate Openeye Name: methyl 1-(3-chloro-4-fluoro-phenyl)sulfonylpiperidine-2-carboxylate CAS Name: 1-(3-chloro-4-fluorophenyl)sulfonyl-2-piperidinecarboxylic acid methyl ester IUPAC Name: methyl 1-(3-chloro-4-fluorophenyl)sulfonylpiperidine-2-carboxylate Traditional Name: 1-(3-chloro-4-fluoro-phenyl)sulfonylpipecolinic acid methyl ester Formula: C13H15ClFNO4S MolecularWeight: 335.778903

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1CCCCN1S(=O)(=O)C2=CC(=C(C=C2)F)Cl

Isomeric SMILES

COC(=O)C1CCCCN1S(=O)(=O)C2=CC(=C(C=C2)F)Cl

InChI

InChI=1S/C13H15ClFNO4S/c1-20-13(17)12-4-2-3-7-16(12)21(18,19)9-5-6-11(15)10(14)8-9/h5-6,8,12H,2-4,7H2,1H3