heptanal; 3-methylhexanal

Systemtic Name: heptanal; 3-methylhexanal Openeye Name: heptanal; 3-methylhexanal CAS Name: heptanal; 3-methylhexanal IUPAC Name: heptanal; 3-methylhexanal Traditional Name: enanthaldehyde; 3-methylhexanal Formula: C14H28O2 MolecularWeight: 228.37092

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCCC=O.CCCC(C)CC=O

Isomeric SMILES

CCCCCCC=O.CCCC(C)CC=O

InChI

InChI=1S/2C7H14O/c1-3-4-7(2)5-6-8;1-2-3-4-5-6-7-8/h6-7H,3-5H2,1-2H3;7H,2-6H2,1H3