1-(4-ethanoyl-1-methyl-pyrrol-2-yl)carbonylpiperidine-4-carboxylic acid

Systemtic Name: 1-(4-ethanoyl-1-methyl-pyrrol-2-yl)carbonylpiperidine-4-carboxylic acid Openeye Name: 1-(4-acetyl-1-methyl-pyrrole-2-carbonyl)piperidine-4-carboxylic acid CAS Name: 1-[(4-acetyl-1-methyl-2-pyrrolyl)-oxomethyl]-4-piperidinecarboxylic acid IUPAC Name: 1-(4-acetyl-1-methylpyrrole-2-carbonyl)piperidine-4-carboxylic acid Traditional Name: 1-(4-acetyl-1-methyl-pyrrole-2-carbonyl)isonipecotic acid Formula: C14H18N2O4 MolecularWeight: 278.30372

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C1=CN(C(=C1)C(=O)N2CCC(CC2)C(=O)O)C

Isomeric SMILES

CC(=O)C1=CN(C(=C1)C(=O)N2CCC(CC2)C(=O)O)C

InChI

InChI=1S/C14H18N2O4/c1-9(17)11-7-12(15(2)8-11)13(18)16-5-3-10(4-6-16)14(19)20/h7-8,10H,3-6H2,1-2H3,(H,19,20)