4-(5-but-3-ynyl-1,2-oxazol-3-ylidene)cyclohexa-2,5-dien-1-one

Systemtic Name: 4-(5-but-3-ynyl-1,2-oxazol-3-ylidene)cyclohexa-2,5-dien-1-one Openeye Name: 4-(5-but-3-ynylisoxazol-3-ylidene)cyclohexa-2,5-dien-1-one CAS Name: 4-(5-but-3-ynyl-3-isoxazolylidene)-1-cyclohexa-2,5-dienone IUPAC Name: 4-(5-but-3-ynyl-1,2-oxazol-3-ylidene)cyclohexa-2,5-dien-1-one Traditional Name: 4-(5-but-3-ynyl-4-isoxazolin-3-ylidene)cyclohexa-2,5-dien-1-one Formula: C13H11NO2 MolecularWeight: 213.23194

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C#CCCC1=CC(=C2C=CC(=O)C=C2)NO1

Isomeric SMILES

C#CCCC1=CC(=C2C=CC(=O)C=C2)NO1

InChI

InChI=1S/C13H11NO2/c1-2-3-4-12-9-13(14-16-12)10-5-7-11(15)8-6-10/h1,5-9,14H,3-4H2