propyl 4-methylpentanoate

Systemtic Name: propyl 4-methylpentanoate Openeye Name: propyl 4-methylpentanoate CAS Name: 4-methylpentanoic acid propyl ester IUPAC Name: propyl 4-methylpentanoate Traditional Name: 4-methylvaleric acid propyl ester Formula: C9H18O2 MolecularWeight: 158.23802

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Descriptors Computed from Structure

Canonical SMILES:

CCCOC(=O)CCC(C)C

Isomeric SMILES

CCCOC(=O)CCC(C)C

InChI

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