2-methyl-4-phenyl-pentanal

Systemtic Name: 2-methyl-4-phenyl-pentanal Openeye Name: 2-methyl-4-phenyl-pentanal CAS Name: 2-methyl-4-phenylpentanal IUPAC Name: 2-methyl-4-phenylpentanal Traditional Name: 2-methyl-4-phenyl-valeraldehyde Formula: C12H16O MolecularWeight: 176.25484

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(CC(C)C1=CC=CC=C1)C=O

Isomeric SMILES

CC(CC(C)C1=CC=CC=C1)C=O

InChI

InChI=1S/C12H16O/c1-10(9-13)8-11(2)12-6-4-3-5-7-12/h3-7,9-11H,8H2,1-2H3