4-hex-5-ynyl-1-(methoxymethyl)-3,5,8-trioxabicyclo[2.2.2]octane-2-carbonitrile

Systemtic Name: 4-hex-5-ynyl-1-(methoxymethyl)-3,5,8-trioxabicyclo[2.2.2]octane-2-carbonitrile Openeye Name: 4-hex-5-ynyl-1-(methoxymethyl)-3,5,8-trioxabicyclo[2.2.2]octane-2-carbonitrile CAS Name: 4-hex-5-ynyl-1-(methoxymethyl)-3,5,8-trioxabicyclo[2.2.2]octane-2-carbonitrile IUPAC Name: 4-hex-5-ynyl-1-(methoxymethyl)-3,5,8-trioxabicyclo[2.2.2]octane-2-carbonitrile Traditional Name: 4-hex-5-ynyl-1-(methoxymethyl)-3,5,8-trioxabicyclo[2.2.2]octane-2-carbonitrile Formula: C14H19NO4 MolecularWeight: 265.30496

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COCC12COC(OC1)(OC2C#N)CCCCC#C

Isomeric SMILES

COCC12COC(OC1)(OC2C#N)CCCCC#C

InChI

InChI=1S/C14H19NO4/c1-3-4-5-6-7-14-17-10-13(9-16-2,11-18-14)12(8-15)19-14/h1,12H,4-7,9-11H2,2H3