(2E)-2-[[4-(hexadecoxymethyl)phenyl]methylidene]-4,7,7-trimethyl-bicyclo[2.2.1]heptan-3-one

Systemtic Name: (2E)-2-[[4-(hexadecoxymethyl)phenyl]methylidene]-4,7,7-trimethyl-bicyclo[2.2.1]heptan-3-one Openeye Name: (3E)-3-[[4-(hexadecoxymethyl)phenyl]methylene]-1,7,7-trimethyl-norbornan-2-one CAS Name: (2E)-2-[[4-(hexadecoxymethyl)phenyl]methylidene]-4,7,7-trimethyl-3-bicyclo[2.2.1]heptanone IUPAC Name: (2E)-2-[[4-(hexadecoxymethyl)phenyl]methylidene]-4,7,7-trimethylbicyclo[2.2.1]heptan-3-one Traditional Name: (3E)-3-[4-(cetyloxymethyl)benzylidene]-1,7,7-trimethyl-norbornan-2-one Formula: C34H54O2 MolecularWeight: 494.79136

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCOCC1=CC=C(C=C1)C=C2C3CCC(C2=O)(C3(C)C)C

Isomeric SMILES

CCCCCCCCCCCCCCCCOCC1=CC=C(C=C1)/C=C/2\C3CCC(C2=O)(C3(C)C)C

InChI

InChI=1S/C34H54O2/c1-5-6-7-8-9-10-11-12-13-14-15-16-17-18-25-36-27-29-21-19-28(20-22-29)26-30-31-23-24-34(4,32(30)35)33(31,2)3/h19-22,26,31H,5-18,23-25,27H2,1-4H3/b30-26+