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

Systemtic Name: 1-[(4-methylsulfanylphenyl)-naphthalen-1-yl-methyl]piperidine-2-carboxylic acid Openeye Name: 1-[(4-methylsulfanylphenyl)-(1-naphthyl)methyl]piperidine-2-carboxylic acid CAS Name: 1-[[4-(methylthio)phenyl]-(1-naphthalenyl)methyl]-2-piperidinecarboxylic acid IUPAC Name: 1-[(4-methylsulfanylphenyl)-naphthalen-1-ylmethyl]piperidine-2-carboxylic acid Traditional Name: 1-[[4-(methylthio)phenyl]-(1-naphthyl)methyl]pipecolinic acid Formula: C24H25NO2S MolecularWeight: 391.5258

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Descriptors Computed from Structure

Canonical SMILES:

CSC1=CC=C(C=C1)C(C2=CC=CC3=CC=CC=C32)N4CCCCC4C(=O)O

Isomeric SMILES

CSC1=CC=C(C=C1)C(C2=CC=CC3=CC=CC=C32)N4CCCCC4C(=O)O

InChI

InChI=1S/C24H25NO2S/c1-28-19-14-12-18(13-15-19)23(25-16-5-4-11-22(25)24(26)27)21-10-6-8-17-7-2-3-9-20(17)21/h2-3,6-10,12-15,22-23H,4-5,11,16H2,1H3,(H,26,27)