6,6-dimethyl-5-[(E)-2-phenylethenyl]bicyclo[3.1.1]hept-2-en-4-one

Systemtic Name: 6,6-dimethyl-5-[(E)-2-phenylethenyl]bicyclo[3.1.1]hept-2-en-4-one Openeye Name: 6,6-dimethyl-5-[(E)-styryl]bicyclo[3.1.1]hept-2-en-4-one CAS Name: 6,6-dimethyl-5-[(E)-2-phenylethenyl]-4-bicyclo[3.1.1]hept-2-enone IUPAC Name: 6,6-dimethyl-5-[(E)-2-phenylethenyl]bicyclo[3.1.1]hept-2-en-4-one Traditional Name: 6,6-dimethyl-5-[(E)-styryl]bicyclo[3.1.1]hept-2-en-4-one Formula: C17H18O MolecularWeight: 238.32422

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1(C2CC1(C(=O)C=C2)C=CC3=CC=CC=C3)C

Isomeric SMILES

CC1(C2CC1(C(=O)C=C2)/C=C/C3=CC=CC=C3)C

InChI

InChI=1S/C17H18O/c1-16(2)14-8-9-15(18)17(16,12-14)11-10-13-6-4-3-5-7-13/h3-11,14H,12H2,1-2H3/b11-10+