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

Systemtic Name: 1-[(4-methylsulfanylphenyl)-naphthalen-2-yl-methyl]piperidine-2-carboxylic acid Openeye Name: 1-[(4-methylsulfanylphenyl)-(2-naphthyl)methyl]piperidine-2-carboxylic acid CAS Name: 1-[[4-(methylthio)phenyl]-(2-naphthalenyl)methyl]-2-piperidinecarboxylic acid IUPAC Name: 1-[(4-methylsulfanylphenyl)-naphthalen-2-ylmethyl]piperidine-2-carboxylic acid Traditional Name: 1-[[4-(methylthio)phenyl]-(2-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=CC3=CC=CC=C3C=C2)N4CCCCC4C(=O)O

Isomeric SMILES

CSC1=CC=C(C=C1)C(C2=CC3=CC=CC=C3C=C2)N4CCCCC4C(=O)O

InChI

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