3-methoxybicyclo[2.2.1]hepta-1,3,5-triene; 4-oxidanylcyclopent-2-en-1-one

Systemtic Name: 3-methoxybicyclo[2.2.1]hepta-1,3,5-triene; 4-oxidanylcyclopent-2-en-1-one Openeye Name: 4-hydroxycyclopent-2-en-1-one; 3-methoxybicyclo[2.2.1]hepta-1,3,5-triene CAS Name: 4-hydroxy-1-cyclopent-2-enone; 3-methoxybicyclo[2.2.1]hepta-1,3,5-triene IUPAC Name: 4-hydroxycyclopent-2-en-1-one; 3-methoxybicyclo[2.2.1]hepta-1,3,5-triene Traditional Name: 4-hydroxycyclopent-2-en-1-one; 3-methoxybicyclo[2.2.1]hepta-1,3,5-triene Formula: C13H14O3 MolecularWeight: 218.24846

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=C2CC(=C1)C=C2.C1C(C=CC1=O)O

Isomeric SMILES

COC1=C2CC(=C1)C=C2.C1C(C=CC1=O)O

InChI

InChI=1S/C8H8O.C5H6O2/c1-9-8-5-6-2-3-7(8)4-6;6-4-1-2-5(7)3-4/h2-3,5H,4H2,1H3;1-2,4,6H,3H2