6-methyl-2-prop-1-en-2-yl-heptanal

Systemtic Name: 6-methyl-2-prop-1-en-2-yl-heptanal Openeye Name: 2-isopropenyl-6-methyl-heptanal CAS Name: 6-methyl-2-(1-methylethenyl)heptanal IUPAC Name: 6-methyl-2-prop-1-en-2-ylheptanal Traditional Name: 2-isohexyl-3-methyl-but-3-enal Formula: C11H20O MolecularWeight: 168.2759

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)CCCC(C=O)C(=C)C

Isomeric SMILES

CC(C)CCCC(C=O)C(=C)C

InChI

InChI=1S/C11H20O/c1-9(2)6-5-7-11(8-12)10(3)4/h8-9,11H,3,5-7H2,1-2,4H3