1-[2-(1,3-benzodioxol-5-yl)ethyl]piperidine-4-carboxylic acid

Systemtic Name: 1-[2-(1,3-benzodioxol-5-yl)ethyl]piperidine-4-carboxylic acid Openeye Name: 1-[2-(1,3-benzodioxol-5-yl)ethyl]piperidine-4-carboxylic acid CAS Name: 1-[2-(1,3-benzodioxol-5-yl)ethyl]-4-piperidinecarboxylic acid IUPAC Name: 1-[2-(1,3-benzodioxol-5-yl)ethyl]piperidine-4-carboxylic acid Traditional Name: 1-homopiperonylisonipecotic acid Formula: C15H19NO4 MolecularWeight: 277.31566

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1C(=O)O)CCC2=CC3=C(C=C2)OCO3

Isomeric SMILES

C1CN(CCC1C(=O)O)CCC2=CC3=C(C=C2)OCO3

InChI

InChI=1S/C15H19NO4/c17-15(18)12-4-7-16(8-5-12)6-3-11-1-2-13-14(9-11)20-10-19-13/h1-2,9,12H,3-8,10H2,(H,17,18)