1-[(E)-3-pyridin-3-ylprop-2-enoyl]piperidine-4-carboxylic acid

Systemtic Name: 1-[(E)-3-pyridin-3-ylprop-2-enoyl]piperidine-4-carboxylic acid Openeye Name: 1-[(E)-3-(3-pyridyl)prop-2-enoyl]piperidine-4-carboxylic acid CAS Name: 1-[(E)-1-oxo-3-(3-pyridinyl)prop-2-enyl]-4-piperidinecarboxylic acid IUPAC Name: 1-[(E)-3-pyridin-3-ylprop-2-enoyl]piperidine-4-carboxylic acid Traditional Name: 1-[(E)-3-(3-pyridyl)acryloyl]isonipecotic acid Formula: C14H16N2O3 MolecularWeight: 260.28844

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1C(=O)O)C(=O)C=CC2=CN=CC=C2

Isomeric SMILES

C1CN(CCC1C(=O)O)C(=O)/C=C/C2=CN=CC=C2

InChI

InChI=1S/C14H16N2O3/c17-13(4-3-11-2-1-7-15-10-11)16-8-5-12(6-9-16)14(18)19/h1-4,7,10,12H,5-6,8-9H2,(H,18,19)/b4-3+