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

Systemtic Name: 1-[(E)-3-thiophen-2-ylprop-2-enoyl]piperidine-4-carboxylate Openeye Name: 1-[(E)-3-(2-thienyl)prop-2-enoyl]piperidine-4-carboxylate CAS Name: 1-[(E)-1-oxo-3-thiophen-2-ylprop-2-enyl]-4-piperidinecarboxylate IUPAC Name: 1-[(E)-3-thiophen-2-ylprop-2-enoyl]piperidine-4-carboxylate Traditional Name: 1-[(E)-3-(2-thienyl)acryloyl]isonipecotate Formula: C13H14NO3S- MolecularWeight: 264.32016

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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)/p-1/b4-3+