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

Systemtic Name: 1-[(E)-3-thiophen-2-ylprop-2-enoyl]piperidine-4-carboxylic acid Openeye Name: 1-[(E)-3-(2-thienyl)prop-2-enoyl]piperidine-4-carboxylic acid CAS Name: 1-[(E)-1-oxo-3-thiophen-2-ylprop-2-enyl]-4-piperidinecarboxylic acid IUPAC Name: 1-[(E)-3-thiophen-2-ylprop-2-enoyl]piperidine-4-carboxylic acid Traditional Name: 1-[(E)-3-(2-thienyl)acryloyl]isonipecotic acid Formula: C13H15NO3S MolecularWeight: 265.3281

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1C(=O)O)C(=O)C=CC2=CC=CS2

Isomeric SMILES

C1CN(CCC1C(=O)O)C(=O)/C=C/C2=CC=CS2

InChI

InChI=1S/C13H15NO3S/c15-12(4-3-11-2-1-9-18-11)14-7-5-10(6-8-14)13(16)17/h1-4,9-10H,5-8H2,(H,16,17)/b4-3+