methyl 4-methylheptanoate

Systemtic Name: methyl 4-methylheptanoate Openeye Name: methyl 4-methylheptanoate CAS Name: 4-methylheptanoic acid methyl ester IUPAC Name: methyl 4-methylheptanoate Traditional Name: 4-methylenanthic acid methyl ester Formula: C9H18O2 MolecularWeight: 158.23802

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCC(C)CCC(=O)OC

Isomeric SMILES

CCCC(C)CCC(=O)OC

InChI

InChI=1S/C9H18O2/c1-4-5-8(2)6-7-9(10)11-3/h8H,4-7H2,1-3H3