(4-azanylidene-3-cyano-2-oxidanylidene-pentyl) anthracene-9-carboxylate

Systemtic Name: (4-azanylidene-3-cyano-2-oxidanylidene-pentyl) anthracene-9-carboxylate Openeye Name: (3-cyano-4-imino-2-oxo-pentyl) anthracene-9-carboxylate CAS Name: 9-anthracenecarboxylic acid (3-cyano-4-imino-2-oxopentyl) ester IUPAC Name: (3-cyano-4-imino-2-oxopentyl) anthracene-9-carboxylate Traditional Name: anthracene-9-carboxylic acid (3-cyano-4-imino-2-keto-pentyl) ester Formula: C21H16N2O3 MolecularWeight: 344.36334

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Descriptors Computed from Structure

Canonical SMILES:

CC(=N)C(C#N)C(=O)COC(=O)C1=C2C=CC=CC2=CC3=CC=CC=C31

Isomeric SMILES

CC(=N)C(C#N)C(=O)COC(=O)C1=C2C=CC=CC2=CC3=CC=CC=C31

InChI

InChI=1S/C21H16N2O3/c1-13(23)18(11-22)19(24)12-26-21(25)20-16-8-4-2-6-14(16)10-15-7-3-5-9-17(15)20/h2-10,18,23H,12H2,1H3