2-[(2-methylfuran-3-yl)carbonylamino]hexanoic acid

Systemtic Name: 2-[(2-methylfuran-3-yl)carbonylamino]hexanoic acid Openeye Name: 2-[(2-methylfuran-3-carbonyl)amino]hexanoic acid CAS Name: 2-[[(2-methyl-3-furanyl)-oxomethyl]amino]hexanoic acid IUPAC Name: 2-[(2-methylfuran-3-carbonyl)amino]hexanoic acid Traditional Name: 2-[(2-methyl-3-furoyl)amino]hexanoic acid Formula: C12H17NO4 MolecularWeight: 239.26768

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCC(C(=O)O)NC(=O)C1=C(OC=C1)C

Isomeric SMILES

CCCCC(C(=O)O)NC(=O)C1=C(OC=C1)C

InChI

InChI=1S/C12H17NO4/c1-3-4-5-10(12(15)16)13-11(14)9-6-7-17-8(9)2/h6-7,10H,3-5H2,1-2H3,(H,13,14)(H,15,16)