4-(4-fluorophenyl)-3-[(4-methylsulfinylphenyl)methoxy]piperidine-1-carboxylic acid

Systemtic Name: 4-(4-fluorophenyl)-3-[(4-methylsulfinylphenyl)methoxy]piperidine-1-carboxylic acid Openeye Name: 4-(4-fluorophenyl)-3-[(4-methylsulfinylphenyl)methoxy]piperidine-1-carboxylic acid CAS Name: 4-(4-fluorophenyl)-3-[(4-methylsulfinylphenyl)methoxy]-1-piperidinecarboxylic acid IUPAC Name: 4-(4-fluorophenyl)-3-[(4-methylsulfinylphenyl)methoxy]piperidine-1-carboxylic acid Traditional Name: 4-(4-fluorophenyl)-3-(4-methylsulfinylbenzyl)oxy-piperidine-1-carboxylic acid Formula: C20H22FNO4S MolecularWeight: 391.456383

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)C1=CC=C(C=C1)COC2CN(CCC2C3=CC=C(C=C3)F)C(=O)O

Isomeric SMILES

CS(=O)C1=CC=C(C=C1)COC2CN(CCC2C3=CC=C(C=C3)F)C(=O)O

InChI

InChI=1S/C20H22FNO4S/c1-27(25)17-8-2-14(3-9-17)13-26-19-12-22(20(23)24)11-10-18(19)15-4-6-16(21)7-5-15/h2-9,18-19H,10-13H2,1H3,(H,23,24)