(E)-4-[4-azanyl-1-(furan-3-yl)butoxy]-4-oxidanylidene-but-2-enoic acid

Systemtic Name: (E)-4-[4-azanyl-1-(furan-3-yl)butoxy]-4-oxidanylidene-but-2-enoic acid Openeye Name: (E)-4-[4-amino-1-(3-furyl)butoxy]-4-oxo-but-2-enoic acid CAS Name: (E)-4-[4-amino-1-(3-furanyl)butoxy]-4-oxo-2-butenoic acid IUPAC Name: (E)-4-[4-amino-1-(furan-3-yl)butoxy]-4-oxobut-2-enoic acid Traditional Name: (E)-4-[4-amino-1-(3-furyl)butoxy]-4-keto-but-2-enoic acid Formula: C12H15NO5 MolecularWeight: 253.2512

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=COC=C1C(CCCN)OC(=O)C=CC(=O)O

Isomeric SMILES

C1=COC=C1C(CCCN)OC(=O)/C=C/C(=O)O

InChI

InChI=1S/C12H15NO5/c13-6-1-2-10(9-5-7-17-8-9)18-12(16)4-3-11(14)15/h3-5,7-8,10H,1-2,6,13H2,(H,14,15)/b4-3+