1-[(2-fluorophenyl)methylsulfonyl]-N-(4-propan-2-yloxyphenyl)piperidine-4-carboxamide

Systemtic Name: 1-[(2-fluorophenyl)methylsulfonyl]-N-(4-propan-2-yloxyphenyl)piperidine-4-carboxamide Openeye Name: 1-[(2-fluorophenyl)methylsulfonyl]-N-(4-isopropoxyphenyl)piperidine-4-carboxamide CAS Name: 1-[(2-fluorophenyl)methylsulfonyl]-N-(4-propan-2-yloxyphenyl)-4-piperidinecarboxamide IUPAC Name: 1-[(2-fluorophenyl)methylsulfonyl]-N-(4-propan-2-yloxyphenyl)piperidine-4-carboxamide Traditional Name: 1-(2-fluorobenzyl)sulfonyl-N-(4-isopropoxyphenyl)isonipecotamide Formula: C22H27FN2O4S MolecularWeight: 434.524183

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)OC1=CC=C(C=C1)NC(=O)C2CCN(CC2)S(=O)(=O)CC3=CC=CC=C3F

Isomeric SMILES

CC(C)OC1=CC=C(C=C1)NC(=O)C2CCN(CC2)S(=O)(=O)CC3=CC=CC=C3F

InChI

InChI=1S/C22H27FN2O4S/c1-16(2)29-20-9-7-19(8-10-20)24-22(26)17-11-13-25(14-12-17)30(27,28)15-18-5-3-4-6-21(18)23/h3-10,16-17H,11-15H2,1-2H3,(H,24,26)