(4-azanylidene-3-cyano-2-oxidanylidene-pentyl) 4-(4-hydroxyphenyl)benzoate

Systemtic Name: (4-azanylidene-3-cyano-2-oxidanylidene-pentyl) 4-(4-hydroxyphenyl)benzoate Openeye Name: (3-cyano-4-imino-2-oxo-pentyl) 4-(4-hydroxyphenyl)benzoate CAS Name: 4-(4-hydroxyphenyl)benzoic acid (3-cyano-4-imino-2-oxopentyl) ester IUPAC Name: (3-cyano-4-imino-2-oxopentyl) 4-(4-hydroxyphenyl)benzoate Traditional Name: 4-(4-hydroxyphenyl)benzoic acid (3-cyano-4-imino-2-keto-pentyl) ester Formula: C19H16N2O4 MolecularWeight: 336.34134

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C19H16N2O4/c1-12(21)17(10-20)18(23)11-25-19(24)15-4-2-13(3-5-15)14-6-8-16(22)9-7-14/h2-9,17,21-22H,11H2,1H3