[(1R)-1-cyanoethyl] 2,5-dimethoxybenzoate

Systemtic Name: [(1R)-1-cyanoethyl] 2,5-dimethoxybenzoate Openeye Name: [(1R)-1-cyanoethyl] 2,5-dimethoxybenzoate CAS Name: 2,5-dimethoxybenzoic acid [(1R)-1-cyanoethyl] ester IUPAC Name: [(1R)-1-cyanoethyl] 2,5-dimethoxybenzoate Traditional Name: 2,5-dimethoxybenzoic acid [(1R)-1-cyanoethyl] ester Formula: C12H13NO4 MolecularWeight: 235.23592

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Descriptors Computed from Structure

Canonical SMILES:

CC(C#N)OC(=O)C1=C(C=CC(=C1)OC)OC

Isomeric SMILES

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

InChI

InChI=1S/C12H13NO4/c1-8(7-13)17-12(14)10-6-9(15-2)4-5-11(10)16-3/h4-6,8H,1-3H3/t8-/m1/s1