4-(4-hydroxyphenyl)-3-[(4-methylsulfanylphenyl)methoxy]piperidine-1-carboxylic acid

Systemtic Name: 4-(4-hydroxyphenyl)-3-[(4-methylsulfanylphenyl)methoxy]piperidine-1-carboxylic acid Openeye Name: 4-(4-hydroxyphenyl)-3-[(4-methylsulfanylphenyl)methoxy]piperidine-1-carboxylic acid CAS Name: 4-(4-hydroxyphenyl)-3-[[4-(methylthio)phenyl]methoxy]-1-piperidinecarboxylic acid IUPAC Name: 4-(4-hydroxyphenyl)-3-[(4-methylsulfanylphenyl)methoxy]piperidine-1-carboxylic acid Traditional Name: 4-(4-hydroxyphenyl)-3-[4-(methylthio)benzyl]oxy-piperidine-1-carboxylic acid Formula: C20H23NO4S MolecularWeight: 373.46592

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Descriptors Computed from Structure

Canonical SMILES:

CSC1=CC=C(C=C1)COC2CN(CCC2C3=CC=C(C=C3)O)C(=O)O

Isomeric SMILES

CSC1=CC=C(C=C1)COC2CN(CCC2C3=CC=C(C=C3)O)C(=O)O

InChI

InChI=1S/C20H23NO4S/c1-26-17-8-2-14(3-9-17)13-25-19-12-21(20(23)24)11-10-18(19)15-4-6-16(22)7-5-15/h2-9,18-19,22H,10-13H2,1H3,(H,23,24)