1-[4,5-bis(chloranyl)-1-methyl-pyrrol-2-yl]carbonylpiperidine-4-carboxylic acid

Systemtic Name: 1-[4,5-bis(chloranyl)-1-methyl-pyrrol-2-yl]carbonylpiperidine-4-carboxylic acid Openeye Name: 1-(4,5-dichloro-1-methyl-pyrrole-2-carbonyl)piperidine-4-carboxylic acid CAS Name: 1-[(4,5-dichloro-1-methyl-2-pyrrolyl)-oxomethyl]-4-piperidinecarboxylic acid IUPAC Name: 1-(4,5-dichloro-1-methylpyrrole-2-carbonyl)piperidine-4-carboxylic acid Traditional Name: 1-(4,5-dichloro-1-methyl-pyrrole-2-carbonyl)isonipecotic acid Formula: C12H14Cl2N2O3 MolecularWeight: 305.15716

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=CC(=C1Cl)Cl)C(=O)N2CCC(CC2)C(=O)O

Isomeric SMILES

CN1C(=CC(=C1Cl)Cl)C(=O)N2CCC(CC2)C(=O)O

InChI

InChI=1S/C12H14Cl2N2O3/c1-15-9(6-8(13)10(15)14)11(17)16-4-2-7(3-5-16)12(18)19/h6-7H,2-5H2,1H3,(H,18,19)