(E)-4-(2-cyclohexylphenoxy)-4-oxidanylidene-but-2-enoic acid

Systemtic Name: (E)-4-(2-cyclohexylphenoxy)-4-oxidanylidene-but-2-enoic acid Openeye Name: (E)-4-(2-cyclohexylphenoxy)-4-oxo-but-2-enoic acid CAS Name: (E)-4-(2-cyclohexylphenoxy)-4-oxo-2-butenoic acid IUPAC Name: (E)-4-(2-cyclohexylphenoxy)-4-oxobut-2-enoic acid Traditional Name: (E)-4-(2-cyclohexylphenoxy)-4-keto-but-2-enoic acid Formula: C16H18O4 MolecularWeight: 274.31172

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)C2=CC=CC=C2OC(=O)C=CC(=O)O

Isomeric SMILES

C1CCC(CC1)C2=CC=CC=C2OC(=O)/C=C/C(=O)O

InChI

InChI=1S/C16H18O4/c17-15(18)10-11-16(19)20-14-9-5-4-8-13(14)12-6-2-1-3-7-12/h4-5,8-12H,1-3,6-7H2,(H,17,18)/b11-10+