(3S)-1-[[4,5-bis(chloranyl)-1H-pyrrol-2-yl]carbonyl]piperidine-3-carboxylate

Systemtic Name: (3S)-1-[[4,5-bis(chloranyl)-1H-pyrrol-2-yl]carbonyl]piperidine-3-carboxylate Openeye Name: (3S)-1-(4,5-dichloro-1H-pyrrole-2-carbonyl)piperidine-3-carboxylate CAS Name: (3S)-1-[(4,5-dichloro-1H-pyrrol-2-yl)-oxomethyl]-3-piperidinecarboxylate IUPAC Name: (3S)-1-(4,5-dichloro-1H-pyrrole-2-carbonyl)piperidine-3-carboxylate Traditional Name: (3S)-1-(4,5-dichloro-1H-pyrrole-2-carbonyl)nipecotate Formula: C11H11Cl2N2O3- MolecularWeight: 290.12264

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(CN(C1)C(=O)C2=CC(=C(N2)Cl)Cl)C(=O)[O-]

Isomeric SMILES

C1C[C@@H](CN(C1)C(=O)C2=CC(=C(N2)Cl)Cl)C(=O)[O-]

InChI

InChI=1S/C11H12Cl2N2O3/c12-7-4-8(14-9(7)13)10(16)15-3-1-2-6(5-15)11(17)18/h4,6,14H,1-3,5H2,(H,17,18)/p-1/t6-/m0/s1