4,5-bis(chloranyl)-2-pyrrolidin-1-ylcarbonyl-benzoic acid

Systemtic Name: 4,5-bis(chloranyl)-2-pyrrolidin-1-ylcarbonyl-benzoic acid Openeye Name: 4,5-dichloro-2-(pyrrolidine-1-carbonyl)benzoic acid CAS Name: 4,5-dichloro-2-[oxo(1-pyrrolidinyl)methyl]benzoic acid IUPAC Name: 4,5-dichloro-2-(pyrrolidine-1-carbonyl)benzoic acid Traditional Name: 4,5-dichloro-2-(pyrrolidine-1-carbonyl)benzoic acid Formula: C12H11Cl2NO3 MolecularWeight: 288.12664

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)C(=O)C2=CC(=C(C=C2C(=O)O)Cl)Cl

Isomeric SMILES

C1CCN(C1)C(=O)C2=CC(=C(C=C2C(=O)O)Cl)Cl

InChI

InChI=1S/C12H11Cl2NO3/c13-9-5-7(8(12(17)18)6-10(9)14)11(16)15-3-1-2-4-15/h5-6H,1-4H2,(H,17,18)