ethyl (E)-3-ethoxy-4-(6-oxidanylidenecyclohexen-1-yl)but-2-enoate

Systemtic Name: ethyl (E)-3-ethoxy-4-(6-oxidanylidenecyclohexen-1-yl)but-2-enoate Openeye Name: ethyl (E)-3-ethoxy-4-(6-oxocyclohexen-1-yl)but-2-enoate CAS Name: (E)-3-ethoxy-4-(6-oxo-1-cyclohexenyl)-2-butenoic acid ethyl ester IUPAC Name: ethyl (E)-3-ethoxy-4-(6-oxocyclohexen-1-yl)but-2-enoate Traditional Name: (E)-3-ethoxy-4-(6-ketocyclohexen-1-yl)but-2-enoic acid ethyl ester Formula: C14H20O4 MolecularWeight: 252.3062

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=CC(=O)OCC)CC1=CCCCC1=O

Isomeric SMILES

CCO/C(=C/C(=O)OCC)/CC1=CCCCC1=O

InChI

InChI=1S/C14H20O4/c1-3-17-12(10-14(16)18-4-2)9-11-7-5-6-8-13(11)15/h7,10H,3-6,8-9H2,1-2H3/b12-10+