3-methylbutyl heptanoate

Systemtic Name: 3-methylbutyl heptanoate Openeye Name: isopentyl heptanoate CAS Name: heptanoic acid 3-methylbutyl ester IUPAC Name: 3-methylbutyl heptanoate Traditional Name: enanthic acid isoamyl ester Formula: C12H24O2 MolecularWeight: 200.31776

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCCC(=O)OCCC(C)C

Isomeric SMILES

CCCCCCC(=O)OCCC(C)C

InChI

InChI=1S/C12H24O2/c1-4-5-6-7-8-12(13)14-10-9-11(2)3/h11H,4-10H2,1-3H3