3-methyl-4-phenyl-butanal

Systemtic Name: 3-methyl-4-phenyl-butanal Openeye Name: 3-methyl-4-phenyl-butanal CAS Name: 3-methyl-4-phenylbutanal IUPAC Name: 3-methyl-4-phenylbutanal Traditional Name: 3-methyl-4-phenyl-butyraldehyde Formula: C11H14O MolecularWeight: 162.22826

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(CC=O)CC1=CC=CC=C1

Isomeric SMILES

CC(CC=O)CC1=CC=CC=C1

InChI

InChI=1S/C11H14O/c1-10(7-8-12)9-11-5-3-2-4-6-11/h2-6,8,10H,7,9H2,1H3