(E)-4-[ethyl(2-ethylbutyl)amino]-4-oxidanylidene-but-2-enoic acid

Systemtic Name: (E)-4-[ethyl(2-ethylbutyl)amino]-4-oxidanylidene-but-2-enoic acid Openeye Name: (E)-4-[ethyl(2-ethylbutyl)amino]-4-oxo-but-2-enoic acid CAS Name: (E)-4-[ethyl(2-ethylbutyl)amino]-4-oxo-2-butenoic acid IUPAC Name: (E)-4-[ethyl(2-ethylbutyl)amino]-4-oxobut-2-enoic acid Traditional Name: (E)-4-[ethyl(2-ethylbutyl)amino]-4-keto-but-2-enoic acid Formula: C12H21NO3 MolecularWeight: 227.30004

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC(CC)CN(CC)C(=O)C=CC(=O)O

Isomeric SMILES

CCC(CC)CN(CC)C(=O)/C=C/C(=O)O

InChI

InChI=1S/C12H21NO3/c1-4-10(5-2)9-13(6-3)11(14)7-8-12(15)16/h7-8,10H,4-6,9H2,1-3H3,(H,15,16)/b8-7+