(2S,3S,4E)-2,3-dimethyl-4-(phenylmethylidene)cyclobutan-1-one

Systemtic Name: (2S,3S,4E)-2,3-dimethyl-4-(phenylmethylidene)cyclobutan-1-one Openeye Name: (2E,3S,4S)-2-benzylidene-3,4-dimethyl-cyclobutanone CAS Name: (2S,3S,4E)-2,3-dimethyl-4-(phenylmethylene)-1-cyclobutanone IUPAC Name: (2E,3S,4S)-2-benzylidene-3,4-dimethylcyclobutan-1-one Traditional Name: (2E,3S,4S)-2-benzal-3,4-dimethyl-cyclobutanone Formula: C13H14O MolecularWeight: 186.24966

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1C(C(=O)C1=CC2=CC=CC=C2)C

Isomeric SMILES

C[C@H]\1[C@@H](C(=O)/C1=C/C2=CC=CC=C2)C

InChI

InChI=1S/C13H14O/c1-9-10(2)13(14)12(9)8-11-6-4-3-5-7-11/h3-10H,1-2H3/b12-8+/t9-,10-/m0/s1