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

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

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(CN(C1)C(=O)C=CC2=CN=CC=C2)C(=O)O

Isomeric SMILES

C1CC(CN(C1)C(=O)/C=C/C2=CN=CC=C2)C(=O)O

InChI

InChI=1S/C14H16N2O3/c17-13(6-5-11-3-1-7-15-9-11)16-8-2-4-12(10-16)14(18)19/h1,3,5-7,9,12H,2,4,8,10H2,(H,18,19)/b6-5+