2-[4-[(E)-3-thiophen-2-ylprop-2-enoyl]piperazin-1-yl]ethanoic acid

Systemtic Name: 2-[4-[(E)-3-thiophen-2-ylprop-2-enoyl]piperazin-1-yl]ethanoic acid Openeye Name: 2-[4-[(E)-3-(2-thienyl)prop-2-enoyl]piperazin-1-yl]acetic acid CAS Name: 2-[4-[(E)-1-oxo-3-thiophen-2-ylprop-2-enyl]-1-piperazinyl]acetic acid IUPAC Name: 2-[4-[(E)-3-thiophen-2-ylprop-2-enoyl]piperazin-1-yl]acetic acid Traditional Name: 2-[4-[(E)-3-(2-thienyl)acryloyl]piperazino]acetic acid Formula: C13H16N2O3S MolecularWeight: 280.34274

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CC(=O)O)C(=O)C=CC2=CC=CS2

Isomeric SMILES

C1CN(CCN1CC(=O)O)C(=O)/C=C/C2=CC=CS2

InChI

InChI=1S/C13H16N2O3S/c16-12(4-3-11-2-1-9-19-11)15-7-5-14(6-8-15)10-13(17)18/h1-4,9H,5-8,10H2,(H,17,18)/b4-3+