methyl 4-ethanoyl-5-oxidanylidene-4-propyl-heptanoate

Systemtic Name: methyl 4-ethanoyl-5-oxidanylidene-4-propyl-heptanoate Openeye Name: methyl 4-acetyl-5-oxo-4-propyl-heptanoate CAS Name: 4-acetyl-5-oxo-4-propylheptanoic acid methyl ester IUPAC Name: methyl 4-acetyl-5-oxo-4-propylheptanoate Traditional Name: 4-acetyl-5-keto-4-propyl-enanthic acid methyl ester Formula: C13H22O4 MolecularWeight: 242.31138

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(CCC(=O)OC)(C(=O)C)C(=O)CC

Isomeric SMILES

CCCC(CCC(=O)OC)(C(=O)C)C(=O)CC

InChI

InChI=1S/C13H22O4/c1-5-8-13(10(3)14,11(15)6-2)9-7-12(16)17-4/h5-9H2,1-4H3