carbonyl dichloride; 1-(4-methylphenyl)sulfonylpyrrolidine-2-carboxylic acid

Systemtic Name: carbonyl dichloride; 1-(4-methylphenyl)sulfonylpyrrolidine-2-carboxylic acid Openeye Name: carbonyl dichloride; 1-(p-tolylsulfonyl)pyrrolidine-2-carboxylic acid CAS Name: carbonic dichloride; 1-(4-methylphenyl)sulfonyl-2-pyrrolidinecarboxylic acid IUPAC Name: carbonyl dichloride; 1-(4-methylphenyl)sulfonylpyrrolidine-2-carboxylic acid Traditional Name: phosgene; 1-tosylproline Formula: C13H15Cl2NO5S MolecularWeight: 368.2329

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)N2CCCC2C(=O)O.C(=O)(Cl)Cl

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)N2CCCC2C(=O)O.C(=O)(Cl)Cl

InChI

InChI=1S/C12H15NO4S.CCl2O/c1-9-4-6-10(7-5-9)18(16,17)13-8-2-3-11(13)12(14)15;2-1(3)4/h4-7,11H,2-3,8H2,1H3,(H,14,15);