(4-azanylidene-3-cyano-2-oxidanylidene-pentyl) (3R)-2,3-dihydro-1,4-benzodioxine-3-carboxylate

Systemtic Name: (4-azanylidene-3-cyano-2-oxidanylidene-pentyl) (3R)-2,3-dihydro-1,4-benzodioxine-3-carboxylate Openeye Name: (3-cyano-4-imino-2-oxo-pentyl) (3R)-2,3-dihydro-1,4-benzodioxine-3-carboxylate CAS Name: (3R)-2,3-dihydro-1,4-benzodioxin-3-carboxylic acid (3-cyano-4-imino-2-oxopentyl) ester IUPAC Name: (3-cyano-4-imino-2-oxopentyl) (3R)-2,3-dihydro-1,4-benzodioxine-3-carboxylate Traditional Name: (3R)-2,3-dihydro-1,4-benzodioxin-3-carboxylic acid (3-cyano-4-imino-2-keto-pentyl) ester Formula: C15H14N2O5 MolecularWeight: 302.28206

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Descriptors Computed from Structure

Canonical SMILES:

CC(=N)C(C#N)C(=O)COC(=O)C1COC2=CC=CC=C2O1

Isomeric SMILES

CC(=N)C(C#N)C(=O)COC(=O)[C@H]1COC2=CC=CC=C2O1

InChI

InChI=1S/C15H14N2O5/c1-9(17)10(6-16)11(18)7-21-15(19)14-8-20-12-4-2-3-5-13(12)22-14/h2-5,10,14,17H,7-8H2,1H3/t10?,14-/m1/s1