(4-azanylidene-3-cyano-2-oxidanylidene-pentyl) 2,2-diphenylethanoate

Systemtic Name: (4-azanylidene-3-cyano-2-oxidanylidene-pentyl) 2,2-diphenylethanoate Openeye Name: (3-cyano-4-imino-2-oxo-pentyl) 2,2-diphenylacetate CAS Name: 2,2-diphenylacetic acid (3-cyano-4-imino-2-oxopentyl) ester IUPAC Name: (3-cyano-4-imino-2-oxopentyl) 2,2-diphenylacetate Traditional Name: 2,2-diphenylacetic acid (3-cyano-4-imino-2-keto-pentyl) ester Formula: C20H18N2O3 MolecularWeight: 334.36852

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(=N)C(C#N)C(=O)COC(=O)C(C1=CC=CC=C1)C2=CC=CC=C2

Isomeric SMILES

CC(=N)C(C#N)C(=O)COC(=O)C(C1=CC=CC=C1)C2=CC=CC=C2

InChI

InChI=1S/C20H18N2O3/c1-14(22)17(12-21)18(23)13-25-20(24)19(15-8-4-2-5-9-15)16-10-6-3-7-11-16/h2-11,17,19,22H,13H2,1H3