N-(5-acetamido-2-fluoranyl-phenyl)-1-(4-methoxyphenyl)sulfonyl-piperidine-3-carboxamide

Systemtic Name: N-(5-acetamido-2-fluoranyl-phenyl)-1-(4-methoxyphenyl)sulfonyl-piperidine-3-carboxamide Openeye Name: N-(5-acetamido-2-fluoro-phenyl)-1-(4-methoxyphenyl)sulfonyl-piperidine-3-carboxamide CAS Name: N-(5-acetamido-2-fluorophenyl)-1-(4-methoxyphenyl)sulfonyl-3-piperidinecarboxamide IUPAC Name: N-(5-acetamido-2-fluorophenyl)-1-(4-methoxyphenyl)sulfonylpiperidine-3-carboxamide Traditional Name: N-(5-acetamido-2-fluoro-phenyl)-1-(4-methoxyphenyl)sulfonyl-nipecotamide Formula: C21H24FN3O5S MolecularWeight: 449.495763

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC1=CC(=C(C=C1)F)NC(=O)C2CCCN(C2)S(=O)(=O)C3=CC=C(C=C3)OC

Isomeric SMILES

CC(=O)NC1=CC(=C(C=C1)F)NC(=O)C2CCCN(C2)S(=O)(=O)C3=CC=C(C=C3)OC

InChI

InChI=1S/C21H24FN3O5S/c1-14(26)23-16-5-10-19(22)20(12-16)24-21(27)15-4-3-11-25(13-15)31(28,29)18-8-6-17(30-2)7-9-18/h5-10,12,15H,3-4,11,13H2,1-2H3,(H,23,26)(H,24,27)