(2S)-1-(4-chloranyl-1-methyl-pyrrol-2-yl)carbonylpiperidine-2-carboxylate

Systemtic Name: (2S)-1-(4-chloranyl-1-methyl-pyrrol-2-yl)carbonylpiperidine-2-carboxylate Openeye Name: (2S)-1-(4-chloro-1-methyl-pyrrole-2-carbonyl)piperidine-2-carboxylate CAS Name: (2S)-1-[(4-chloro-1-methyl-2-pyrrolyl)-oxomethyl]-2-piperidinecarboxylate IUPAC Name: (2S)-1-(4-chloro-1-methylpyrrole-2-carbonyl)piperidine-2-carboxylate Traditional Name: (2S)-1-(4-chloro-1-methyl-pyrrole-2-carbonyl)pipecolinate Formula: C12H14ClN2O3- MolecularWeight: 269.70416

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=C(C=C1C(=O)N2CCCCC2C(=O)[O-])Cl

Isomeric SMILES

CN1C=C(C=C1C(=O)N2CCCC[C@H]2C(=O)[O-])Cl

InChI

InChI=1S/C12H15ClN2O3/c1-14-7-8(13)6-10(14)11(16)15-5-3-2-4-9(15)12(17)18/h6-7,9H,2-5H2,1H3,(H,17,18)/p-1/t9-/m0/s1