3-[4-[(4-fluoranylphenoxy)methyl]piperidin-1-yl]sulfonyl-4-phenyl-butanoic acid

Systemtic Name: 3-[4-[(4-fluoranylphenoxy)methyl]piperidin-1-yl]sulfonyl-4-phenyl-butanoic acid Openeye Name: 3-[[4-[(4-fluorophenoxy)methyl]-1-piperidyl]sulfonyl]-4-phenyl-butanoic acid CAS Name: 3-[[4-[(4-fluorophenoxy)methyl]-1-piperidinyl]sulfonyl]-4-phenylbutanoic acid IUPAC Name: 3-[4-[(4-fluorophenoxy)methyl]piperidin-1-yl]sulfonyl-4-phenylbutanoic acid Traditional Name: 3-[4-[(4-fluorophenoxy)methyl]piperidino]sulfonyl-4-phenyl-butyric acid Formula: C22H26FNO5S MolecularWeight: 435.508943

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1COC2=CC=C(C=C2)F)S(=O)(=O)C(CC3=CC=CC=C3)CC(=O)O

Isomeric SMILES

C1CN(CCC1COC2=CC=C(C=C2)F)S(=O)(=O)C(CC3=CC=CC=C3)CC(=O)O

InChI

InChI=1S/C22H26FNO5S/c23-19-6-8-20(9-7-19)29-16-18-10-12-24(13-11-18)30(27,28)21(15-22(25)26)14-17-4-2-1-3-5-17/h1-9,18,21H,10-16H2,(H,25,26)