(1E)-2-cyano-3-oxidanylidene-4-(4-oxidanylphenoxy)-1-pyrrol-2-ylidene-pentan-1-olate

Systemtic Name: (1E)-2-cyano-3-oxidanylidene-4-(4-oxidanylphenoxy)-1-pyrrol-2-ylidene-pentan-1-olate Openeye Name: (1E)-2-cyano-4-(4-hydroxyphenoxy)-3-oxo-1-pyrrol-2-ylidene-pentan-1-olate CAS Name: (1E)-2-cyano-4-(4-hydroxyphenoxy)-3-oxo-1-(2-pyrrolylidene)-1-pentanolate IUPAC Name: (1E)-2-cyano-4-(4-hydroxyphenoxy)-3-oxo-1-pyrrol-2-ylidenepentan-1-olate Traditional Name: (1E)-2-cyano-4-(4-hydroxyphenoxy)-3-keto-1-pyrrol-2-ylidene-pentan-1-olate Formula: C16H13N2O4- MolecularWeight: 297.28542

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)C(C#N)C(=C1C=CC=N1)[O-])OC2=CC=C(C=C2)O

Isomeric SMILES

CC(C(=O)C(C#N)/C(=C\1/C=CC=N1)/[O-])OC2=CC=C(C=C2)O

InChI

InChI=1S/C16H14N2O4/c1-10(22-12-6-4-11(19)5-7-12)15(20)13(9-17)16(21)14-3-2-8-18-14/h2-8,10,13,19,21H,1H3/p-1/b16-14+