methyl 4-methyl-5-oxidanylidene-heptanoate

Systemtic Name: methyl 4-methyl-5-oxidanylidene-heptanoate Openeye Name: methyl 4-methyl-5-oxo-heptanoate CAS Name: 4-methyl-5-oxoheptanoic acid methyl ester IUPAC Name: methyl 4-methyl-5-oxoheptanoate Traditional Name: 5-keto-4-methyl-enanthic acid methyl ester Formula: C9H16O3 MolecularWeight: 172.22154

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Descriptors Computed from Structure

Canonical SMILES:

CCC(=O)C(C)CCC(=O)OC

Isomeric SMILES

CCC(=O)C(C)CCC(=O)OC

InChI

InChI=1S/C9H16O3/c1-4-8(10)7(2)5-6-9(11)12-3/h7H,4-6H2,1-3H3