N-[(3,4-diethoxyphenyl)methyl]-1-[(2-fluorophenyl)methylsulfonyl]piperidine-4-carboxamide

Systemtic Name: N-[(3,4-diethoxyphenyl)methyl]-1-[(2-fluorophenyl)methylsulfonyl]piperidine-4-carboxamide Openeye Name: N-[(3,4-diethoxyphenyl)methyl]-1-[(2-fluorophenyl)methylsulfonyl]piperidine-4-carboxamide CAS Name: N-[(3,4-diethoxyphenyl)methyl]-1-[(2-fluorophenyl)methylsulfonyl]-4-piperidinecarboxamide IUPAC Name: N-[(3,4-diethoxyphenyl)methyl]-1-[(2-fluorophenyl)methylsulfonyl]piperidine-4-carboxamide Traditional Name: N-(3,4-diethoxybenzyl)-1-(2-fluorobenzyl)sulfonyl-isonipecotamide Formula: C24H31FN2O5S MolecularWeight: 478.576743

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C(C=C1)CNC(=O)C2CCN(CC2)S(=O)(=O)CC3=CC=CC=C3F)OCC

Isomeric SMILES

CCOC1=C(C=C(C=C1)CNC(=O)C2CCN(CC2)S(=O)(=O)CC3=CC=CC=C3F)OCC

InChI

InChI=1S/C24H31FN2O5S/c1-3-31-22-10-9-18(15-23(22)32-4-2)16-26-24(28)19-11-13-27(14-12-19)33(29,30)17-20-7-5-6-8-21(20)25/h5-10,15,19H,3-4,11-14,16-17H2,1-2H3,(H,26,28)