(4-azanylidene-3-cyano-2-oxidanylidene-pentyl) 2-benzo[e][1]benzofuran-1-ylethanoate

Systemtic Name: (4-azanylidene-3-cyano-2-oxidanylidene-pentyl) 2-benzo[e][1]benzofuran-1-ylethanoate Openeye Name: (3-cyano-4-imino-2-oxo-pentyl) 2-benzo[e]benzofuran-1-ylacetate CAS Name: 2-(1-benzo[e]benzofuranyl)acetic acid (3-cyano-4-imino-2-oxopentyl) ester IUPAC Name: (3-cyano-4-imino-2-oxopentyl) 2-benzo[e][1]benzofuran-1-ylacetate Traditional Name: 2-benzo[e]benzofuran-1-ylacetic acid (3-cyano-4-imino-2-keto-pentyl) ester Formula: C20H16N2O4 MolecularWeight: 348.35204

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Descriptors Computed from Structure

Canonical SMILES:

CC(=N)C(C#N)C(=O)COC(=O)CC1=COC2=C1C3=CC=CC=C3C=C2

Isomeric SMILES

CC(=N)C(C#N)C(=O)COC(=O)CC1=COC2=C1C3=CC=CC=C3C=C2

InChI

InChI=1S/C20H16N2O4/c1-12(22)16(9-21)17(23)11-26-19(24)8-14-10-25-18-7-6-13-4-2-3-5-15(13)20(14)18/h2-7,10,16,22H,8,11H2,1H3