[(E)-4-azanyl-3-cyano-2-oxidanylidene-pent-3-enyl] 2,3-dihydro-1,4-benzodioxine-6-carboxylate

Systemtic Name: [(E)-4-azanyl-3-cyano-2-oxidanylidene-pent-3-enyl] 2,3-dihydro-1,4-benzodioxine-6-carboxylate Openeye Name: [(E)-4-amino-3-cyano-2-oxo-pent-3-enyl] 2,3-dihydro-1,4-benzodioxine-6-carboxylate CAS Name: 2,3-dihydro-1,4-benzodioxin-6-carboxylic acid [(E)-4-amino-3-cyano-2-oxopent-3-enyl] ester IUPAC Name: [(E)-4-amino-3-cyano-2-oxopent-3-enyl] 2,3-dihydro-1,4-benzodioxine-6-carboxylate Traditional Name: 2,3-dihydro-1,4-benzodioxin-6-carboxylic acid [(E)-4-amino-3-cyano-2-keto-pent-3-enyl] ester Formula: C15H14N2O5 MolecularWeight: 302.28206

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

C/C(=C(/C#N)\C(=O)COC(=O)C1=CC2=C(C=C1)OCCO2)/N

InChI

InChI=1S/C15H14N2O5/c1-9(17)11(7-16)12(18)8-22-15(19)10-2-3-13-14(6-10)21-5-4-20-13/h2-3,6H,4-5,8,17H2,1H3/b11-9+