6-[[(E)-3-(furan-2-yl)prop-2-enoyl]amino]hexanoic acid

Systemtic Name: 6-[[(E)-3-(furan-2-yl)prop-2-enoyl]amino]hexanoic acid Openeye Name: 6-[[(E)-3-(2-furyl)prop-2-enoyl]amino]hexanoic acid CAS Name: 6-[[(E)-3-(2-furanyl)-1-oxoprop-2-enyl]amino]hexanoic acid IUPAC Name: 6-[[(E)-3-(furan-2-yl)prop-2-enoyl]amino]hexanoic acid Traditional Name: 6-[[(E)-3-(2-furyl)acryloyl]amino]hexanoic acid Formula: C13H17NO4 MolecularWeight: 251.27838

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C13H17NO4/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+