1-(3-chloranyl-4-fluoranyl-phenyl)sulfonyl-N-(3,4-diethoxyphenyl)piperidine-4-carboxamide

Systemtic Name: 1-(3-chloranyl-4-fluoranyl-phenyl)sulfonyl-N-(3,4-diethoxyphenyl)piperidine-4-carboxamide Openeye Name: 1-(3-chloro-4-fluoro-phenyl)sulfonyl-N-(3,4-diethoxyphenyl)piperidine-4-carboxamide CAS Name: 1-(3-chloro-4-fluorophenyl)sulfonyl-N-(3,4-diethoxyphenyl)-4-piperidinecarboxamide IUPAC Name: 1-(3-chloro-4-fluorophenyl)sulfonyl-N-(3,4-diethoxyphenyl)piperidine-4-carboxamide Traditional Name: 1-(3-chloro-4-fluoro-phenyl)sulfonyl-N-(3,4-diethoxyphenyl)isonipecotamide Formula: C22H26ClFN2O5S MolecularWeight: 484.968643

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C(C=C1)NC(=O)C2CCN(CC2)S(=O)(=O)C3=CC(=C(C=C3)F)Cl)OCC

Isomeric SMILES

CCOC1=C(C=C(C=C1)NC(=O)C2CCN(CC2)S(=O)(=O)C3=CC(=C(C=C3)F)Cl)OCC

InChI

InChI=1S/C22H26ClFN2O5S/c1-3-30-20-8-5-16(13-21(20)31-4-2)25-22(27)15-9-11-26(12-10-15)32(28,29)17-6-7-19(24)18(23)14-17/h5-8,13-15H,3-4,9-12H2,1-2H3,(H,25,27)