6-[[(E)-3-thiophen-2-ylprop-2-enoyl]amino]hexanoic acid

Systemtic Name: 6-[[(E)-3-thiophen-2-ylprop-2-enoyl]amino]hexanoic acid Openeye Name: 6-[[(E)-3-(2-thienyl)prop-2-enoyl]amino]hexanoic acid CAS Name: 6-[[(E)-1-oxo-3-thiophen-2-ylprop-2-enyl]amino]hexanoic acid IUPAC Name: 6-[[(E)-3-thiophen-2-ylprop-2-enoyl]amino]hexanoic acid Traditional Name: 6-[[(E)-3-(2-thienyl)acryloyl]amino]hexanoic acid Formula: C13H17NO3S MolecularWeight: 267.34398

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CSC(=C1)C=CC(=O)NCCCCCC(=O)O

Isomeric SMILES

C1=CSC(=C1)/C=C/C(=O)NCCCCCC(=O)O

InChI

InChI=1S/C13H17NO3S/c15-12(8-7-11-5-4-10-18-11)14-9-3-1-2-6-13(16)17/h4-5,7-8,10H,1-3,6,9H2,(H,14,15)(H,16,17)/b8-7+