(E)-4-oxidanylidene-4-(3,3,5-trimethylcyclohexyl)oxy-but-2-enoic acid

Systemtic Name: (E)-4-oxidanylidene-4-(3,3,5-trimethylcyclohexyl)oxy-but-2-enoic acid Openeye Name: (E)-4-oxo-4-(3,3,5-trimethylcyclohexoxy)but-2-enoic acid CAS Name: (E)-4-oxo-4-(3,3,5-trimethylcyclohexyl)oxy-2-butenoic acid IUPAC Name: (E)-4-oxo-4-(3,3,5-trimethylcyclohexyl)oxybut-2-enoic acid Traditional Name: (E)-4-keto-4-(3,3,5-trimethylcyclohexoxy)but-2-enoic acid Formula: C13H20O4 MolecularWeight: 240.2955

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1CC(CC(C1)(C)C)OC(=O)C=CC(=O)O

Isomeric SMILES

CC1CC(CC(C1)(C)C)OC(=O)/C=C/C(=O)O

InChI

InChI=1S/C13H20O4/c1-9-6-10(8-13(2,3)7-9)17-12(16)5-4-11(14)15/h4-5,9-10H,6-8H2,1-3H3,(H,14,15)/b5-4+