1-[2-[(4-ethoxyphenyl)sulfonyl-(4-fluorophenyl)amino]ethanoyl]piperidine-4-carboxamide

Systemtic Name: 1-[2-[(4-ethoxyphenyl)sulfonyl-(4-fluorophenyl)amino]ethanoyl]piperidine-4-carboxamide Openeye Name: 1-[2-(N-(4-ethoxyphenyl)sulfonyl-4-fluoro-anilino)acetyl]piperidine-4-carboxamide CAS Name: 1-[2-(N-(4-ethoxyphenyl)sulfonyl-4-fluoroanilino)-1-oxoethyl]-4-piperidinecarboxamide IUPAC Name: 1-[2-(N-(4-ethoxyphenyl)sulfonyl-4-fluoroanilino)acetyl]piperidine-4-carboxamide Traditional Name: 1-[2-(4-fluoro-N-p-phenetylsulfonyl-anilino)acetyl]isonipecotamide Formula: C22H26FN3O5S MolecularWeight: 463.522343

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)S(=O)(=O)N(CC(=O)N2CCC(CC2)C(=O)N)C3=CC=C(C=C3)F

Isomeric SMILES

CCOC1=CC=C(C=C1)S(=O)(=O)N(CC(=O)N2CCC(CC2)C(=O)N)C3=CC=C(C=C3)F

InChI

InChI=1S/C22H26FN3O5S/c1-2-31-19-7-9-20(10-8-19)32(29,30)26(18-5-3-17(23)4-6-18)15-21(27)25-13-11-16(12-14-25)22(24)28/h3-10,16H,2,11-15H2,1H3,(H2,24,28)