1-[3-[(4-methylphenyl)disulfanyl]butanoyl]pyrrolidine-2-carboxylic acid

Systemtic Name: 1-[3-[(4-methylphenyl)disulfanyl]butanoyl]pyrrolidine-2-carboxylic acid Openeye Name: 1-[3-(p-tolyldisulfanyl)butanoyl]pyrrolidine-2-carboxylic acid CAS Name: 1-[3-[(4-methylphenyl)disulfanyl]-1-oxobutyl]-2-pyrrolidinecarboxylic acid IUPAC Name: 1-[3-[(4-methylphenyl)disulfanyl]butanoyl]pyrrolidine-2-carboxylic acid Traditional Name: 1-[3-(p-tolyldisulfanyl)butanoyl]proline Formula: C16H21NO3S2 MolecularWeight: 339.47284

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)SSC(C)CC(=O)N2CCCC2C(=O)O

Isomeric SMILES

CC1=CC=C(C=C1)SSC(C)CC(=O)N2CCCC2C(=O)O

InChI

InChI=1S/C16H21NO3S2/c1-11-5-7-13(8-6-11)22-21-12(2)10-15(18)17-9-3-4-14(17)16(19)20/h5-8,12,14H,3-4,9-10H2,1-2H3,(H,19,20)