[(2S)-1-butoxy-1-oxidanylidene-propan-2-yl] 3,4-dimethylbenzoate

Systemtic Name: [(2S)-1-butoxy-1-oxidanylidene-propan-2-yl] 3,4-dimethylbenzoate Openeye Name: [(1S)-2-butoxy-1-methyl-2-oxo-ethyl] 3,4-dimethylbenzoate CAS Name: 3,4-dimethylbenzoic acid [(2S)-1-butoxy-1-oxopropan-2-yl] ester IUPAC Name: [(2S)-1-butoxy-1-oxopropan-2-yl] 3,4-dimethylbenzoate Traditional Name: 3,4-dimethylbenzoic acid [(1S)-2-butoxy-2-keto-1-methyl-ethyl] ester Formula: C16H22O4 MolecularWeight: 278.34348

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC(=O)C(C)OC(=O)C1=CC(=C(C=C1)C)C

Isomeric SMILES

CCCCOC(=O)[C@H](C)OC(=O)C1=CC(=C(C=C1)C)C

InChI

InChI=1S/C16H22O4/c1-5-6-9-19-15(17)13(4)20-16(18)14-8-7-11(2)12(3)10-14/h7-8,10,13H,5-6,9H2,1-4H3/t13-/m0/s1