(4-azanylidene-3-cyano-2-oxidanylidene-pentyl) 2-(4-oxidanylidenequinazolin-3-yl)ethanoate

Systemtic Name: (4-azanylidene-3-cyano-2-oxidanylidene-pentyl) 2-(4-oxidanylidenequinazolin-3-yl)ethanoate Openeye Name: (3-cyano-4-imino-2-oxo-pentyl) 2-(4-oxoquinazolin-3-yl)acetate CAS Name: 2-(4-oxo-3-quinazolinyl)acetic acid (3-cyano-4-imino-2-oxopentyl) ester IUPAC Name: (3-cyano-4-imino-2-oxopentyl) 2-(4-oxoquinazolin-3-yl)acetate Traditional Name: 2-(4-ketoquinazolin-3-yl)acetic acid (3-cyano-4-imino-2-keto-pentyl) ester Formula: C16H14N4O4 MolecularWeight: 326.30676

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Descriptors Computed from Structure

Canonical SMILES:

CC(=N)C(C#N)C(=O)COC(=O)CN1C=NC2=CC=CC=C2C1=O

Isomeric SMILES

CC(=N)C(C#N)C(=O)COC(=O)CN1C=NC2=CC=CC=C2C1=O

InChI

InChI=1S/C16H14N4O4/c1-10(18)12(6-17)14(21)8-24-15(22)7-20-9-19-13-5-3-2-4-11(13)16(20)23/h2-5,9,12,18H,7-8H2,1H3