phenyl 2-ethyl-3-methyl-butanoate

Systemtic Name: phenyl 2-ethyl-3-methyl-butanoate Openeye Name: phenyl 2-ethyl-3-methyl-butanoate CAS Name: 2-ethyl-3-methylbutanoic acid phenyl ester IUPAC Name: phenyl 2-ethyl-3-methylbutanoate Traditional Name: 2-ethyl-3-methyl-butyric acid phenyl ester Formula: C13H18O2 MolecularWeight: 206.28082

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C(C)C)C(=O)OC1=CC=CC=C1

Isomeric SMILES

CCC(C(C)C)C(=O)OC1=CC=CC=C1

InChI

InChI=1S/C13H18O2/c1-4-12(10(2)3)13(14)15-11-8-6-5-7-9-11/h5-10,12H,4H2,1-3H3