heptanal; 5-methylhexanal

Systemtic Name: heptanal; 5-methylhexanal Openeye Name: heptanal; 5-methylhexanal CAS Name: heptanal; 5-methylhexanal IUPAC Name: heptanal; 5-methylhexanal Traditional Name: enanthaldehyde; 5-methylhexanal Formula: C14H28O2 MolecularWeight: 228.37092

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCC=O.CC(C)CCCC=O

Isomeric SMILES

CCCCCCC=O.CC(C)CCCC=O

InChI

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