1-(2-naphthalen-1-ylethylsulfonyl)-4-sulfanyl-pyrrolidine-2-carboxylic acid

Systemtic Name: 1-(2-naphthalen-1-ylethylsulfonyl)-4-sulfanyl-pyrrolidine-2-carboxylic acid Openeye Name: 1-[2-(1-naphthyl)ethylsulfonyl]-4-sulfanyl-pyrrolidine-2-carboxylic acid CAS Name: 4-mercapto-1-[2-(1-naphthalenyl)ethylsulfonyl]-2-pyrrolidinecarboxylic acid IUPAC Name: 1-(2-naphthalen-1-ylethylsulfonyl)-4-sulfanylpyrrolidine-2-carboxylic acid Traditional Name: 4-mercapto-1-[2-(1-naphthyl)ethylsulfonyl]proline Formula: C17H19NO4S2 MolecularWeight: 365.46706

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Descriptors Computed from Structure

Canonical SMILES:

C1C(CN(C1C(=O)O)S(=O)(=O)CCC2=CC=CC3=CC=CC=C32)S

Isomeric SMILES

C1C(CN(C1C(=O)O)S(=O)(=O)CCC2=CC=CC3=CC=CC=C32)S

InChI

InChI=1S/C17H19NO4S2/c19-17(20)16-10-14(23)11-18(16)24(21,22)9-8-13-6-3-5-12-4-1-2-7-15(12)13/h1-7,14,16,23H,8-11H2,(H,19,20)