1-(1,3-benzodioxol-5-ylcarbonyl)piperidine-4-carboxylic acid

Systemtic Name: 1-(1,3-benzodioxol-5-ylcarbonyl)piperidine-4-carboxylic acid Openeye Name: 1-(1,3-benzodioxole-5-carbonyl)piperidine-4-carboxylic acid CAS Name: 1-[1,3-benzodioxol-5-yl(oxo)methyl]-4-piperidinecarboxylic acid IUPAC Name: 1-(1,3-benzodioxole-5-carbonyl)piperidine-4-carboxylic acid Traditional Name: 1-piperonyloylisonipecotic acid Formula: C14H15NO5 MolecularWeight: 277.2726

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1C(=O)O)C(=O)C2=CC3=C(C=C2)OCO3

Isomeric SMILES

C1CN(CCC1C(=O)O)C(=O)C2=CC3=C(C=C2)OCO3

InChI

InChI=1S/C14H15NO5/c16-13(15-5-3-9(4-6-15)14(17)18)10-1-2-11-12(7-10)20-8-19-11/h1-2,7,9H,3-6,8H2,(H,17,18)