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

Systemtic Name: (4-azanylidene-3-cyano-2-oxidanylidene-pentyl) 3,3-diphenylpropanoate Openeye Name: (3-cyano-4-imino-2-oxo-pentyl) 3,3-diphenylpropanoate CAS Name: 3,3-diphenylpropanoic acid (3-cyano-4-imino-2-oxopentyl) ester IUPAC Name: (3-cyano-4-imino-2-oxopentyl) 3,3-diphenylpropanoate Traditional Name: 3,3-diphenylpropionic acid (3-cyano-4-imino-2-keto-pentyl) ester Formula: C21H20N2O3 MolecularWeight: 348.3951

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H20N2O3/c1-15(23)19(13-22)20(24)14-26-21(25)12-18(16-8-4-2-5-9-16)17-10-6-3-7-11-17/h2-11,18-19,23H,12,14H2,1H3