ethyl 3-butyl-2-methyl-7-oxidanyl-heptanoate

Systemtic Name: ethyl 3-butyl-2-methyl-7-oxidanyl-heptanoate Openeye Name: ethyl 3-butyl-7-hydroxy-2-methyl-heptanoate CAS Name: 3-butyl-7-hydroxy-2-methylheptanoic acid ethyl ester IUPAC Name: ethyl 3-butyl-7-hydroxy-2-methylheptanoate Traditional Name: 3-butyl-7-hydroxy-2-methyl-enanthic acid ethyl ester Formula: C14H28O3 MolecularWeight: 244.37032

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(CCCCO)C(C)C(=O)OCC

Isomeric SMILES

CCCCC(CCCCO)C(C)C(=O)OCC

InChI

InChI=1S/C14H28O3/c1-4-6-9-13(10-7-8-11-15)12(3)14(16)17-5-2/h12-13,15H,4-11H2,1-3H3