N-(2,5-diethoxyphenyl)-1-(2-fluorophenyl)sulfonyl-piperidine-4-carboxamide

Systemtic Name: N-(2,5-diethoxyphenyl)-1-(2-fluorophenyl)sulfonyl-piperidine-4-carboxamide Openeye Name: N-(2,5-diethoxyphenyl)-1-(2-fluorophenyl)sulfonyl-piperidine-4-carboxamide CAS Name: N-(2,5-diethoxyphenyl)-1-(2-fluorophenyl)sulfonyl-4-piperidinecarboxamide IUPAC Name: N-(2,5-diethoxyphenyl)-1-(2-fluorophenyl)sulfonylpiperidine-4-carboxamide Traditional Name: N-(2,5-diethoxyphenyl)-1-(2-fluorophenyl)sulfonyl-isonipecotamide Formula: C22H27FN2O5S MolecularWeight: 450.523583

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC(=C(C=C1)OCC)NC(=O)C2CCN(CC2)S(=O)(=O)C3=CC=CC=C3F

Isomeric SMILES

CCOC1=CC(=C(C=C1)OCC)NC(=O)C2CCN(CC2)S(=O)(=O)C3=CC=CC=C3F

InChI

InChI=1S/C22H27FN2O5S/c1-3-29-17-9-10-20(30-4-2)19(15-17)24-22(26)16-11-13-25(14-12-16)31(27,28)21-8-6-5-7-18(21)23/h5-10,15-16H,3-4,11-14H2,1-2H3,(H,24,26)