1-cyanoethyl 2,3-dihydro-1,4-benzodioxine-6-carboxylate

Systemtic Name: 1-cyanoethyl 2,3-dihydro-1,4-benzodioxine-6-carboxylate Openeye Name: 1-cyanoethyl 2,3-dihydro-1,4-benzodioxine-6-carboxylate CAS Name: 2,3-dihydro-1,4-benzodioxin-6-carboxylic acid 1-cyanoethyl ester IUPAC Name: 1-cyanoethyl 2,3-dihydro-1,4-benzodioxine-6-carboxylate Traditional Name: 2,3-dihydro-1,4-benzodioxin-6-carboxylic acid 1-cyanoethyl ester Formula: C12H11NO4 MolecularWeight: 233.22004

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Descriptors Computed from Structure

Canonical SMILES:

CC(C#N)OC(=O)C1=CC2=C(C=C1)OCCO2

Isomeric SMILES

CC(C#N)OC(=O)C1=CC2=C(C=C1)OCCO2

InChI

InChI=1S/C12H11NO4/c1-8(7-13)17-12(14)9-2-3-10-11(6-9)16-5-4-15-10/h2-3,6,8H,4-5H2,1H3