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

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

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(CN(C1)C(=O)C=CC2=CC=CS2)C(=O)O

Isomeric SMILES

C1C[C@@H](CN(C1)C(=O)/C=C/C2=CC=CS2)C(=O)O

InChI

InChI=1S/C13H15NO3S/c15-12(6-5-11-4-2-8-18-11)14-7-1-3-10(9-14)13(16)17/h2,4-6,8,10H,1,3,7,9H2,(H,16,17)/b6-5+/t10-/m0/s1