N-[(4-ethoxy-3-methoxy-phenyl)methyl]-1-(4-fluorophenyl)sulfonyl-piperidine-2-carboxamide

Systemtic Name: N-[(4-ethoxy-3-methoxy-phenyl)methyl]-1-(4-fluorophenyl)sulfonyl-piperidine-2-carboxamide Openeye Name: N-[(4-ethoxy-3-methoxy-phenyl)methyl]-1-(4-fluorophenyl)sulfonyl-piperidine-2-carboxamide CAS Name: N-[(4-ethoxy-3-methoxyphenyl)methyl]-1-(4-fluorophenyl)sulfonyl-2-piperidinecarboxamide IUPAC Name: N-[(4-ethoxy-3-methoxyphenyl)methyl]-1-(4-fluorophenyl)sulfonylpiperidine-2-carboxamide Traditional Name: N-(4-ethoxy-3-methoxy-benzyl)-1-(4-fluorophenyl)sulfonyl-pipecolinamide Formula: C22H27FN2O5S MolecularWeight: 450.523583

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C(C=C1)CNC(=O)C2CCCCN2S(=O)(=O)C3=CC=C(C=C3)F)OC

Isomeric SMILES

CCOC1=C(C=C(C=C1)CNC(=O)C2CCCCN2S(=O)(=O)C3=CC=C(C=C3)F)OC

InChI

InChI=1S/C22H27FN2O5S/c1-3-30-20-12-7-16(14-21(20)29-2)15-24-22(26)19-6-4-5-13-25(19)31(27,28)18-10-8-17(23)9-11-18/h7-12,14,19H,3-6,13,15H2,1-2H3,(H,24,26)