N-[(3,4-dimethoxyphenyl)methyl]-1-(2-fluorophenyl)sulfonyl-N-methyl-piperidine-4-carboxamide

Systemtic Name: N-[(3,4-dimethoxyphenyl)methyl]-1-(2-fluorophenyl)sulfonyl-N-methyl-piperidine-4-carboxamide Openeye Name: N-[(3,4-dimethoxyphenyl)methyl]-1-(2-fluorophenyl)sulfonyl-N-methyl-piperidine-4-carboxamide CAS Name: N-[(3,4-dimethoxyphenyl)methyl]-1-(2-fluorophenyl)sulfonyl-N-methyl-4-piperidinecarboxamide IUPAC Name: N-[(3,4-dimethoxyphenyl)methyl]-1-(2-fluorophenyl)sulfonyl-N-methylpiperidine-4-carboxamide Traditional Name: 1-(2-fluorophenyl)sulfonyl-N-methyl-N-veratryl-isonipecotamide Formula: C22H27FN2O5S MolecularWeight: 450.523583

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Descriptors Computed from Structure

Canonical SMILES:

CN(CC1=CC(=C(C=C1)OC)OC)C(=O)C2CCN(CC2)S(=O)(=O)C3=CC=CC=C3F

Isomeric SMILES

CN(CC1=CC(=C(C=C1)OC)OC)C(=O)C2CCN(CC2)S(=O)(=O)C3=CC=CC=C3F

InChI

InChI=1S/C22H27FN2O5S/c1-24(15-16-8-9-19(29-2)20(14-16)30-3)22(26)17-10-12-25(13-11-17)31(27,28)21-7-5-4-6-18(21)23/h4-9,14,17H,10-13,15H2,1-3H3