(E)-4-[furan-2-ylmethyl(2-methylpropyl)amino]-4-oxidanylidene-but-2-enoic acid

Systemtic Name: (E)-4-[furan-2-ylmethyl(2-methylpropyl)amino]-4-oxidanylidene-but-2-enoic acid Openeye Name: (E)-4-[2-furylmethyl(isobutyl)amino]-4-oxo-but-2-enoic acid CAS Name: (E)-4-[2-furanylmethyl(2-methylpropyl)amino]-4-oxo-2-butenoic acid IUPAC Name: (E)-4-[furan-2-ylmethyl(2-methylpropyl)amino]-4-oxobut-2-enoic acid Traditional Name: (E)-4-[2-furfuryl(isobutyl)amino]-4-keto-but-2-enoic acid Formula: C13H17NO4 MolecularWeight: 251.27838

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)CN(CC1=CC=CO1)C(=O)C=CC(=O)O

Isomeric SMILES

CC(C)CN(CC1=CC=CO1)C(=O)/C=C/C(=O)O

InChI

InChI=1S/C13H17NO4/c1-10(2)8-14(9-11-4-3-7-18-11)12(15)5-6-13(16)17/h3-7,10H,8-9H2,1-2H3,(H,16,17)/b6-5+