(E)-6-methyl-6-(oxan-2-yloxy)hept-2-en-4-ynoic acid

Systemtic Name: (E)-6-methyl-6-(oxan-2-yloxy)hept-2-en-4-ynoic acid Openeye Name: (E)-6-methyl-6-tetrahydropyran-2-yloxy-hept-2-en-4-ynoic acid CAS Name: (E)-6-methyl-6-(2-oxanyloxy)hept-2-en-4-ynoic acid IUPAC Name: (E)-6-methyl-6-(oxan-2-yloxy)hept-2-en-4-ynoic acid Traditional Name: (E)-6-methyl-6-tetrahydropyran-2-yloxy-hept-2-en-4-ynoic acid Formula: C13H18O4 MolecularWeight: 238.27962

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C#CC=CC(=O)O)OC1CCCCO1

Isomeric SMILES

CC(C)(C#C/C=C/C(=O)O)OC1CCCCO1

InChI

InChI=1S/C13H18O4/c1-13(2,9-5-3-7-11(14)15)17-12-8-4-6-10-16-12/h3,7,12H,4,6,8,10H2,1-2H3,(H,14,15)/b7-3+