(4-azanylidene-3-cyano-2-oxidanylidene-pentyl) 2-[2-(phenylmethyl)phenoxy]ethanoate

Systemtic Name: (4-azanylidene-3-cyano-2-oxidanylidene-pentyl) 2-[2-(phenylmethyl)phenoxy]ethanoate Openeye Name: (3-cyano-4-imino-2-oxo-pentyl) 2-(2-benzylphenoxy)acetate CAS Name: 2-[2-(phenylmethyl)phenoxy]acetic acid (3-cyano-4-imino-2-oxopentyl) ester IUPAC Name: (3-cyano-4-imino-2-oxopentyl) 2-(2-benzylphenoxy)acetate Traditional Name: 2-(2-benzylphenoxy)acetic acid (3-cyano-4-imino-2-keto-pentyl) ester Formula: C21H20N2O4 MolecularWeight: 364.3945

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Descriptors Computed from Structure

Canonical SMILES:

CC(=N)C(C#N)C(=O)COC(=O)COC1=CC=CC=C1CC2=CC=CC=C2

Isomeric SMILES

CC(=N)C(C#N)C(=O)COC(=O)COC1=CC=CC=C1CC2=CC=CC=C2

InChI

InChI=1S/C21H20N2O4/c1-15(23)18(12-22)19(24)13-27-21(25)14-26-20-10-6-5-9-17(20)11-16-7-3-2-4-8-16/h2-10,18,23H,11,13-14H2,1H3