N-(3-chloranyl-4-fluoranyl-phenyl)-1-[(3-methyl-2-oxidanylidene-1,3-benzoxazol-6-yl)sulfonyl]piperidine-4-carboxamide

Systemtic Name: N-(3-chloranyl-4-fluoranyl-phenyl)-1-[(3-methyl-2-oxidanylidene-1,3-benzoxazol-6-yl)sulfonyl]piperidine-4-carboxamide Openeye Name: N-(3-chloro-4-fluoro-phenyl)-1-[(3-methyl-2-oxo-1,3-benzoxazol-6-yl)sulfonyl]piperidine-4-carboxamide CAS Name: N-(3-chloro-4-fluorophenyl)-1-[(3-methyl-2-oxo-1,3-benzoxazol-6-yl)sulfonyl]-4-piperidinecarboxamide IUPAC Name: N-(3-chloro-4-fluorophenyl)-1-[(3-methyl-2-oxo-1,3-benzoxazol-6-yl)sulfonyl]piperidine-4-carboxamide Traditional Name: N-(3-chloro-4-fluoro-phenyl)-1-[(2-keto-3-methyl-1,3-benzoxazol-6-yl)sulfonyl]isonipecotamide Formula: C20H19ClFN3O5S MolecularWeight: 467.898363

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CN1C2=C(C=C(C=C2)S(=O)(=O)N3CCC(CC3)C(=O)NC4=CC(=C(C=C4)F)Cl)OC1=O

Isomeric SMILES

CN1C2=C(C=C(C=C2)S(=O)(=O)N3CCC(CC3)C(=O)NC4=CC(=C(C=C4)F)Cl)OC1=O

InChI

InChI=1S/C20H19ClFN3O5S/c1-24-17-5-3-14(11-18(17)30-20(24)27)31(28,29)25-8-6-12(7-9-25)19(26)23-13-2-4-16(22)15(21)10-13/h2-5,10-12H,6-9H2,1H3,(H,23,26)