1-cyanoethyl 3-methoxy-2-oxidanyl-benzoate

Systemtic Name: 1-cyanoethyl 3-methoxy-2-oxidanyl-benzoate Openeye Name: 1-cyanoethyl 2-hydroxy-3-methoxy-benzoate CAS Name: 2-hydroxy-3-methoxybenzoic acid 1-cyanoethyl ester IUPAC Name: 1-cyanoethyl 2-hydroxy-3-methoxybenzoate Traditional Name: 2-hydroxy-3-methoxy-benzoic acid 1-cyanoethyl ester Formula: C11H11NO4 MolecularWeight: 221.20934

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C11H11NO4/c1-7(6-12)16-11(14)8-4-3-5-9(15-2)10(8)13/h3-5,7,13H,1-2H3