1-[(4-methylsulfanylphenyl)-phenyl-methyl]piperidine-2-carboxylic acid

Systemtic Name: 1-[(4-methylsulfanylphenyl)-phenyl-methyl]piperidine-2-carboxylic acid Openeye Name: 1-[(4-methylsulfanylphenyl)-phenyl-methyl]piperidine-2-carboxylic acid CAS Name: 1-[[4-(methylthio)phenyl]-phenylmethyl]-2-piperidinecarboxylic acid IUPAC Name: 1-[(4-methylsulfanylphenyl)-phenylmethyl]piperidine-2-carboxylic acid Traditional Name: 1-[[4-(methylthio)phenyl]-phenyl-methyl]pipecolinic acid Formula: C20H23NO2S MolecularWeight: 341.46712

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Descriptors Computed from Structure

Canonical SMILES:

CSC1=CC=C(C=C1)C(C2=CC=CC=C2)N3CCCCC3C(=O)O

Isomeric SMILES

CSC1=CC=C(C=C1)C(C2=CC=CC=C2)N3CCCCC3C(=O)O

InChI

InChI=1S/C20H23NO2S/c1-24-17-12-10-16(11-13-17)19(15-7-3-2-4-8-15)21-14-6-5-9-18(21)20(22)23/h2-4,7-8,10-13,18-19H,5-6,9,14H2,1H3,(H,22,23)