ethyl 2-prop-1-en-2-ylheptanoate

Systemtic Name: ethyl 2-prop-1-en-2-ylheptanoate Openeye Name: ethyl 2-isopropenylheptanoate CAS Name: 2-(1-methylethenyl)heptanoic acid ethyl ester IUPAC Name: ethyl 2-prop-1-en-2-ylheptanoate Traditional Name: 2-amyl-3-methyl-but-3-enoic acid ethyl ester Formula: C12H22O2 MolecularWeight: 198.30188

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCC(C(=C)C)C(=O)OCC

Isomeric SMILES

CCCCCC(C(=C)C)C(=O)OCC

InChI

InChI=1S/C12H22O2/c1-5-7-8-9-11(10(3)4)12(13)14-6-2/h11H,3,5-9H2,1-2,4H3