(4-azanylidene-3-cyano-2-oxidanylidene-pentyl) 2-(4-phenylazanylphenoxy)ethanoate

Systemtic Name: (4-azanylidene-3-cyano-2-oxidanylidene-pentyl) 2-(4-phenylazanylphenoxy)ethanoate Openeye Name: (3-cyano-4-imino-2-oxo-pentyl) 2-(4-anilinophenoxy)acetate CAS Name: 2-(4-anilinophenoxy)acetic acid (3-cyano-4-imino-2-oxopentyl) ester IUPAC Name: (3-cyano-4-imino-2-oxopentyl) 2-(4-anilinophenoxy)acetate Traditional Name: 2-(4-anilinophenoxy)acetic acid (3-cyano-4-imino-2-keto-pentyl) ester Formula: C20H19N3O4 MolecularWeight: 365.38256

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(=N)C(C#N)C(=O)COC(=O)COC1=CC=C(C=C1)NC2=CC=CC=C2

Isomeric SMILES

CC(=N)C(C#N)C(=O)COC(=O)COC1=CC=C(C=C1)NC2=CC=CC=C2

InChI

InChI=1S/C20H19N3O4/c1-14(22)18(11-21)19(24)12-27-20(25)13-26-17-9-7-16(8-10-17)23-15-5-3-2-4-6-15/h2-10,18,22-23H,12-13H2,1H3