[(1S)-1-cyanoethyl] 3,5-dimethoxy-4-methyl-benzoate

Systemtic Name: [(1S)-1-cyanoethyl] 3,5-dimethoxy-4-methyl-benzoate Openeye Name: [(1S)-1-cyanoethyl] 3,5-dimethoxy-4-methyl-benzoate CAS Name: 3,5-dimethoxy-4-methylbenzoic acid [(1S)-1-cyanoethyl] ester IUPAC Name: [(1S)-1-cyanoethyl] 3,5-dimethoxy-4-methylbenzoate Traditional Name: 3,5-dimethoxy-4-methyl-benzoic acid [(1S)-1-cyanoethyl] ester Formula: C13H15NO4 MolecularWeight: 249.2625

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1OC)C(=O)OC(C)C#N)OC

Isomeric SMILES

CC1=C(C=C(C=C1OC)C(=O)O[C@@H](C)C#N)OC

InChI

InChI=1S/C13H15NO4/c1-8(7-14)18-13(15)10-5-11(16-3)9(2)12(6-10)17-4/h5-6,8H,1-4H3/t8-/m0/s1