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

Systemtic Name: 1-[(4-methylsulfanylphenyl)-naphthalen-1-yl-methyl]pyrrolidine-2-carboxylic acid Openeye Name: 1-[(4-methylsulfanylphenyl)-(1-naphthyl)methyl]pyrrolidine-2-carboxylic acid CAS Name: 1-[[4-(methylthio)phenyl]-(1-naphthalenyl)methyl]-2-pyrrolidinecarboxylic acid IUPAC Name: 1-[(4-methylsulfanylphenyl)-naphthalen-1-ylmethyl]pyrrolidine-2-carboxylic acid Traditional Name: 1-[[4-(methylthio)phenyl]-(1-naphthyl)methyl]proline Formula: C23H23NO2S MolecularWeight: 377.49922

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Descriptors Computed from Structure

Canonical SMILES:

CSC1=CC=C(C=C1)C(C2=CC=CC3=CC=CC=C32)N4CCCC4C(=O)O

Isomeric SMILES

CSC1=CC=C(C=C1)C(C2=CC=CC3=CC=CC=C32)N4CCCC4C(=O)O

InChI

InChI=1S/C23H23NO2S/c1-27-18-13-11-17(12-14-18)22(24-15-5-10-21(24)23(25)26)20-9-4-7-16-6-2-3-8-19(16)20/h2-4,6-9,11-14,21-22H,5,10,15H2,1H3,(H,25,26)