(2S)-2-(furan-2-yl)-2-(3-methylbutylcarbamoylamino)propanoic acid

Systemtic Name: (2S)-2-(furan-2-yl)-2-(3-methylbutylcarbamoylamino)propanoic acid Openeye Name: (2S)-2-(2-furyl)-2-(isopentylcarbamoylamino)propanoic acid CAS Name: (2S)-2-(2-furanyl)-2-[[(3-methylbutylamino)-oxomethyl]amino]propanoic acid IUPAC Name: (2S)-2-(furan-2-yl)-2-(3-methylbutylcarbamoylamino)propanoic acid Traditional Name: (2S)-2-(2-furyl)-2-(isoamylcarbamoylamino)propionic acid Formula: C13H20N2O4 MolecularWeight: 268.3089

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)CCNC(=O)NC(C)(C1=CC=CO1)C(=O)O

Isomeric SMILES

CC(C)CCNC(=O)N[C@@](C)(C1=CC=CO1)C(=O)O

InChI

InChI=1S/C13H20N2O4/c1-9(2)6-7-14-12(18)15-13(3,11(16)17)10-5-4-8-19-10/h4-5,8-9H,6-7H2,1-3H3,(H,16,17)(H2,14,15,18)/t13-/m0/s1