(4-azanylidene-3-cyano-2-oxidanylidene-pentyl) 2-(4-chloranylphenoxy)-2-methyl-propanoate

Systemtic Name: (4-azanylidene-3-cyano-2-oxidanylidene-pentyl) 2-(4-chloranylphenoxy)-2-methyl-propanoate Openeye Name: (3-cyano-4-imino-2-oxo-pentyl) 2-(4-chlorophenoxy)-2-methyl-propanoate CAS Name: 2-(4-chlorophenoxy)-2-methylpropanoic acid (3-cyano-4-imino-2-oxopentyl) ester IUPAC Name: (3-cyano-4-imino-2-oxopentyl) 2-(4-chlorophenoxy)-2-methylpropanoate Traditional Name: 2-(4-chlorophenoxy)-2-methyl-propionic acid (3-cyano-4-imino-2-keto-pentyl) ester Formula: C16H17ClN2O4 MolecularWeight: 336.77018

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Descriptors Computed from Structure

Canonical SMILES:

CC(=N)C(C#N)C(=O)COC(=O)C(C)(C)OC1=CC=C(C=C1)Cl

Isomeric SMILES

CC(=N)C(C#N)C(=O)COC(=O)C(C)(C)OC1=CC=C(C=C1)Cl

InChI

InChI=1S/C16H17ClN2O4/c1-10(19)13(8-18)14(20)9-22-15(21)16(2,3)23-12-6-4-11(17)5-7-12/h4-7,13,19H,9H2,1-3H3