2-[(3,5-dimethylphenyl)methyl]-1-dithiocarboxy-4-oxidanyl-pyrrolidine-2-carboxylic acid

Systemtic Name: 2-[(3,5-dimethylphenyl)methyl]-1-dithiocarboxy-4-oxidanyl-pyrrolidine-2-carboxylic acid Openeye Name: 2-[(3,5-dimethylphenyl)methyl]-1-dithiocarboxy-4-hydroxy-pyrrolidine-2-carboxylic acid CAS Name: 2-[(3,5-dimethylphenyl)methyl]-1-dithiocarboxy-4-hydroxy-2-pyrrolidinecarboxylic acid IUPAC Name: 2-[(3,5-dimethylphenyl)methyl]-1-dithiocarboxy-4-hydroxypyrrolidine-2-carboxylic acid Traditional Name: 2-(3,5-dimethylbenzyl)-1-dithiocarboxy-4-hydroxy-proline Formula: C15H19NO3S2 MolecularWeight: 325.44626

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1)CC2(CC(CN2C(=S)S)O)C(=O)O)C

Isomeric SMILES

CC1=CC(=CC(=C1)CC2(CC(CN2C(=S)S)O)C(=O)O)C

InChI

InChI=1S/C15H19NO3S2/c1-9-3-10(2)5-11(4-9)6-15(13(18)19)7-12(17)8-16(15)14(20)21/h3-5,12,17H,6-8H2,1-2H3,(H,18,19)(H,20,21)