3-methyl-1-phenyl-octan-4-one

Systemtic Name: 3-methyl-1-phenyl-octan-4-one Openeye Name: 3-methyl-1-phenyl-octan-4-one CAS Name: 3-methyl-1-phenyl-4-octanone IUPAC Name: 3-methyl-1-phenyloctan-4-one Traditional Name: 3-methyl-1-phenyl-octan-4-one Formula: C15H22O MolecularWeight: 218.33458

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCC(=O)C(C)CCC1=CC=CC=C1

Isomeric SMILES

CCCCC(=O)C(C)CCC1=CC=CC=C1

InChI

InChI=1S/C15H22O/c1-3-4-10-15(16)13(2)11-12-14-8-6-5-7-9-14/h5-9,13H,3-4,10-12H2,1-2H3